Structure Information
Structure

Compound Identification

SMILES

CCN(CC#C)CC1=NN=C2C(C)N=C(C3=CC=CC=C3)C3=C(C=C(C=C3)[N+]([O-])=O)N12

InChIKey

InChIKey=LPHDUCYICMOGDA-UHFFFAOYSA-N

Formula

C23H22N6O2

Mass

414.469

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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 - Nitroaromatic compound - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - 1,2,4-triazole - Ketimine - C-nitro compound - Tertiary amine - Tertiary aliphatic amine - Organic nitro compound - Acetylide - Organic oxoazanium - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Amine - Organic nitrogen compound - Organic zwitterion - Organic salt - Organic oxygen compound - Imine - Organopnictogen 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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