Structure Information
Structure

Compound Identification

SMILES

COC1=CC2=C(C=C1)N1C(C)=NN=C1[C@H](NC(=O)C1=CC=CC(=C1)C1=CC3=C(COB3O)C=C1)N=C2C1=CC=C(Cl)C=C1

InChIKey

InChIKey=AVSAWRMOJPNPBJ-PMERELPUSA-N

Formula

C32H25BClN5O4

Mass

589.84

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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 - Benzamide - Benzoic acid or derivatives - Anisole - Benzoyl - Phenol ether - Alkyl aryl ether - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Boronic acid ester - 1,2-oxaborole derivative - 1,2,4-triazole - Boronic acid derivative - Carboxamide group - Ketimine - Secondary carboxylic acid amide - Oxacycle - Azacycle - Organic metalloid salt - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Ether - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organic nitrogen compound - Organic metalloid moeity - Organic oxygen compound - Organohalogen compound - Imine - 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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