Aminobenzoic acids and derivatives

Description:

Benzoic acids (or derivative thereof) containing an amine group attached to the benzene moiety.

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  1. Declopramide
    CAS: 891-60-1 Formula: C13H20ClN3O Molecular Weight: 269.77
    Out of Stock Item #: D1359732
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    IUPAC Name
    4-amino-3-chloro-N-[2-(diethylamino)ethyl]benzamide
    SMILES
    CCN(CC)CCNC(=O)C1=CC(=C(C=C1)N)Cl
    InChIKey
    YEYAKZXEBSVURO-UHFFFAOYSA-N
    InChI
    1S/C13H20ClN3O/c1-3-17(4-2)8-7-16-13(18)10-5-6-12(15)11(14)9-10/h5-6,9H,3-4,7-8,15H2,1-2H3,(H,16,18)
  2. 4-(7-Nitro-benzo[1,2,5]oxadiazol-4-ylamino)-benzoic acid
    CAS: 389076-27-1 Formula: C13H8N4O5 Molecular Weight: 300.23
    Out of Stock Item #: N1286886
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    IUPAC Name
    4-[(4-nitro-2,1,3-benzoxadiazol-7-yl)amino]benzoic acid
    SMILES
    C1=CC(=CC=C1C(=O)O)NC2=CC=C(C3=NON=C23)[N+](=O)[O-]
    InChIKey
    ZEIZFLAEFWOEKQ-UHFFFAOYSA-N
    InChI
    1S/C13H8N4O5/c18-13(19)7-1-3-8(4-2-7)14-9-5-6-10(17(20)21)12-11(9)15-22-16-12/h1-6,14H,(H,18,19)
  3. (S)-amisulpride
    CAS: 71675-92-8 PubChem CID: 3055076
    Out of Stock Item #: S1352876
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    IUPAC Name
    4-amino-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-5-ethylsulfonyl-2-methoxybenzamide
    SMILES
    CCN1CCCC1CNC(=O)C2=CC(=C(C=C2OC)N)S(=O)(=O)CC
    InChIKey
    NTJOBXMMWNYJFB-LBPRGKRZSA-N
    InChI
    1S/C17H27N3O4S/c1-4-20-8-6-7-12(20)11-19-17(21)13-9-16(25(22,23)5-2)14(18)10-15(13)24-3/h9-10,12H,4-8,11,18H2,1-3H3,(H,19,21)/t12-/m0/s1
  4. Relenopride Hydrochloride
    CAS: 1221416-42-7 Formula: C24H31Cl2FN4O4 Molecular Weight: 529.4
    Out of Stock Item #: R1242658
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    IUPAC Name
    [(1S)-3-[4-[[(4-amino-5-chloro-2-methoxybenzoyl)amino]methyl]piperidin-1-yl]-1-(4-fluorophenyl)propyl] carbamate;hydrochloride
    SMILES
    COC1=CC(=C(C=C1C(=O)NCC2CCN(CC2)CC[C@@H](C3=CC=C(C=C3)F)OC(=O)N)Cl)N.Cl
    InChIKey
    DMJJYQFHCCNBNI-BOXHHOBZSA-N
    InChI
    1S/C24H30ClFN4O4.ClH/c1-33-22-13-20(27)19(25)12-18(22)23(31)29-14-15-6-9-30(10-7-15)11-8-21(34-24(28)32)16-2-4-17(26)5-3-16;/h2-5,12-13,15,21H,6-11,14show more
  5. Mefenamic Acid D4
    CAS: 1216745-79-7 PubChem CID: 45359018 Formula: C15H11D4NO2 Molecular Weight: 245.31
    Out of Stock Item #: M938595
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    IUPAC Name
    2,3,4,5-tetradeuterio-6-(2,3-dimethylanilino)benzoic acid
    SMILES
    CC1=C(C(=CC=C1)NC2=CC=CC=C2C(=O)O)C
    InChIKey
    HYYBABOKPJLUIN-KNIGXJNHSA-N
    InChI
    1S/C15H15NO2/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18/h3-9,16H,1-2H3,(H,17,18)/i3D,4D,7D,8D
  6. Lintopride
    CAS: 107429-63-0 PubChem CID: 65900
    Out of Stock Item #: L1343461
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    IUPAC Name
    4-amino-5-chloro-N-[(1-ethyl-4,5-dihydroimidazol-2-yl)methyl]-2-methoxybenzamide
    SMILES
    CCN1CCN=C1CNC(=O)C2=CC(=C(C=C2OC)N)Cl
    InChIKey
    MJCKISCWHDATBN-UHFFFAOYSA-N
    InChI
    1S/C14H19ClN4O2/c1-3-19-5-4-17-13(19)8-18-14(20)9-6-10(15)11(16)7-12(9)21-2/h6-7H,3-5,8,16H2,1-2H3,(H,18,20)
  7. Ethyl 2-(3-fluoro-4-(methylcarbamoyl)phenylamino)-2-methylpropanoate
    CAS: 1258638-92-4 PubChem CID: 56971687
    Out of Stock Item #: E1056329
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    IUPAC Name
    ethyl 2-[3-fluoro-4-(methylcarbamoyl)anilino]-2-methylpropanoate
    SMILES
    CCOC(=O)C(C)(C)NC1=CC(=C(C=C1)C(=O)NC)F
    InChIKey
    GBQUYIPPBGFGPC-UHFFFAOYSA-N
    InChI
    1S/C14H19FN2O3/c1-5-20-13(19)14(2,3)17-9-6-7-10(11(15)8-9)12(18)16-4/h6-8,17H,5H2,1-4H3,(H,16,18)
  8. DMABA NHS ester
    CAS: 58068-85-2 PubChem CID: 71312544 Formula: C13H14N2O4 Molecular Weight: 262.26
    Out of Stock Item #: D769805
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    Technical Identifiers
    IUPAC Name
    (2,5-dioxopyrrolidin-1-yl) 4-(dimethylamino)benzoate
    SMILES
    CN(C)C1=CC=C(C=C1)C(=O)ON2C(=O)CCC2=O
    InChIKey
    FNGFZOAQGYOQTG-UHFFFAOYSA-N
    InChI
    1S/C13H14N2O4/c1-14(2)10-5-3-9(4-6-10)13(18)19-15-11(16)7-8-12(15)17/h3-6H,7-8H2,1-2H3
  9. Amisulpride hydrochloride
    CAS: 81342-13-4 PubChem CID: 10046897
    Out of Stock Item #: A768893
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    Technical Identifiers
    IUPAC Name
    4-amino-N-[(1-ethylpyrrolidin-2-yl)methyl]-5-ethylsulfonyl-2-methoxybenzamide;hydrochloride
    SMILES
    CCN1CCCC1CNC(=O)C2=CC(=C(C=C2OC)N)S(=O)(=O)CC.Cl
    InChIKey
    XFOYXFDTUMXXFP-UHFFFAOYSA-N
    InChI
    1S/C17H27N3O4S.ClH/c1-4-20-8-6-7-12(20)11-19-17(21)13-9-16(25(22,23)5-2)14(18)10-15(13)24-3;/h9-10,12H,4-8,11,18H2,1-3H3,(H,19,21);1H
  10. 5-Bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)-3-(ethyl(tetrahydro-2H-pyran-4-yl)amino)-2-methylbenzamide
    CAS: 1403257-80-6 PubChem CID: 66576790 Formula: C23H30BrN3O3
    Out of Stock Item #: B769161
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    Technical Identifiers
    IUPAC Name
    5-bromo-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-[ethyl(oxan-4-yl)amino]-2-methylbenzamide
    SMILES
    CCN(C1CCOCC1)C2=CC(=CC(=C2C)C(=O)NCC3=C(C=C(NC3=O)C)C)Br
    InChIKey
    FADJTYGNEWCCFM-UHFFFAOYSA-N
    InChI
    1S/C23H30BrN3O3/c1-5-27(18-6-8-30-9-7-18)21-12-17(24)11-19(16(21)4)22(28)25-13-20-14(2)10-15(3)26-23(20)29/h10-12,18H,5-9,13H2,1-4H3,(H,25,28)(H,26,29show more
  11. Benzoyl chloride, 4-(dimethylamino)-, hydrochloride (1:1)
    CAS: 149898-87-3 Formula: C9H11Cl2NO Molecular Weight: 220.0957
    Out of Stock Item #: B771004
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    Technical Identifiers
    SMILES
    CN(C)C1=CC=C(C=C1)C(=O)Cl.Cl
    InChIKey
    AKWWGJAWIMCXCW-UHFFFAOYSA-N
    InChI
    1S/C9H10ClNO.ClH/c1-11(2)8-5-3-7(4-6-8)9(10)12;/h3-6H,1-2H3;1H
  12. 4-Aminobenzoic acid hydrochloride
    CAS: 22669-27-8 EC Number: 683-716-1 Formula: C7H8ClNO2 Molecular Weight: 173.60
    Solid ≥98%
    Out of Stock Item #: A770476
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    Technical Identifiers
    IUPAC Name
    4-aminobenzoic acid;hydrochloride
    SMILES
    C1=CC(=CC=C1C(=O)O)N.Cl
    InChIKey
    KBCPMQUSOLSAQO-UHFFFAOYSA-N
    InChI
    1S/C7H7NO2.ClH/c8-6-3-1-5(2-4-6)7(9)10;/h1-4H,8H2,(H,9,10);1H
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