Structure Information
Structure

Compound Identification

SMILES

CC1=CC(C)=NC(O[C@H](C(O)=O)[C@]2(NCC(=O)N(CC3=CC=CC=C3Cl)C3=CC=CC=C23)C2=CC=CC=C2)=N1

InChIKey

InChIKey=QCHYZDXDWZKACW-OFSOJUDTSA-N

Formula

C30H27ClN4O4

Mass

543.02

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodiazepines

Subclass

1,4-benzodiazepines

Intermediate Tree Nodes

Not available

Direct Parent

1,4-benzodiazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1,4-benzodiazepine - 3-phenylpropanoic-acid - Alpha-amino acid or derivatives - Alkyl aryl ether - Chlorobenzene - Aralkylamine - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Amino acid - Carboxamide group - Lactam - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Secondary amine - Ether - Secondary aliphatic amine - Azacycle - Carboxylic acid - Organooxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1,4-benzodiazepines. These are organic compounds containing a benzene ring fused to a 1,4-azepine.

External Descriptors

Not available

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