Structure Information
Structure

Compound Identification

SMILES

CC1CC2=C(C=C(Cl)C=C2)C(=NN1C(=O)C(F)(F)F)C1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=RETZCWFYSRWREZ-UHFFFAOYSA-N

Formula

C18H13ClF3N3O3

Mass

411.77

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzodiazepines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Benzodiazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzodiazepine - Nitrobenzene - Nitroaromatic compound - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Organic nitro compound - C-nitro compound - Azacycle - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Alkyl fluoride - Alkyl halide - Organofluoride - Organochloride - Organonitrogen compound - Organohalogen compound - Organooxygen compound - Organic salt - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzodiazepines. These are organic compounds containing a benzene ring fused to either isomers of diazepine(unsaturated seven-member heterocycle with two nitrogen atoms replacing two carbon atoms).

External Descriptors

Not available

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