tert-butyl 1-oxo-1,2,3,5-tetrahydrospiro[2-benzazepine-4,4'-piperidine]-1'-carboxylate - ≥97% , CAS No.1160247-87-9

CAS: 1160247-87-9 Cat. No.: T627058 Molecular Weight: 330.43 PubChem CID: 71305426

GRADE & PURITY ≥97%

Synonyms

1160247-87-9 | tert-Butyl 1-oxo-1,2,3,5-tetrahydrospiro[benzo[c]azepine-4,4'-piperidine]-1'-carboxylate | Tert-Butyl 1-Oxo-1,2,3,5-Tetrahydrospiro[Benzo[C]Azepine-4,4-Piperidine]-1-Carboxylate | tert-butyl 1-oxospiro[3,5-dihydro-2H-2-benzazepine-4,4'-pipe

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

1160247-87-9 | tert-Butyl 1-oxo-1, 2, 3, 5-tetrahydrospiro[benzo[c]azepine-4, 4'-piperidine]-1'-carboxylate | Tert-Butyl 1-Oxo-1, 2, 3, 5-Tetrahydrospiro[Benzo[C]Azepine-4, 4-Piperidine]-1-Carboxylate | tert-butyl 1-oxospiro[3, 5-dihydro-2H-2-benzazepine-4, 4'-pipe

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CC(C)(C)OC(=O)N1CCC2(CC1)CC3=CC=CC=C3C(=O)NC2
• IUPAC Name: tert-butyl 1-oxospiro[3,5-dihydro-2H-2-benzazepine-4,4'-piperidine]-1'-carboxylate
• InChIKey: RZEDOSUYWFGFTQ-UHFFFAOYSA-N
• INCHI: 1S/C19H26N2O3/c1-18(2,3)24-17(23)21-10-8-19(9-11-21)12-14-6-4-5-7-15(14)16(22)20-13-19/h4-7H,8-13H2,1-3H3,(H,20,22)
• PubChem CID: 71305426
• Molecular Weight: 330.43

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Benzazepines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Benzazepines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzazepines
• Alternative Parents: Piperidinecarboxylic acids Azepines Benzenoids Carbamate esters Secondary carboxylic acid amides Lactams Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Benzazepine - Piperidinecarboxylic acid - Azepine - Piperidine - Benzenoid - Carbamic acid ester - Secondary carboxylic acid amide - Lactam - Carboxamide group - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as benzazepines. These are organic compounds containing a benzene ring fused to an azepine ring (unsaturated seven-membered heterocycle with one nitrogen atom replacing a carbon atom).
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y