Structure Information
Structure

Compound Identification

SMILES

CC1=CC(CNC(=O)N2N\C(C=C2C2CC2)=C2\C=CC(NC(=O)C3=CC=CC=C3Cl)=CC2=O)=CC=C1

InChIKey

InChIKey=OPOFEADTVJCBEP-GYHWCHFESA-N

Formula

C28H25ClN4O3

Mass

500.98

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Halobenzoic acids and derivatives

Direct Parent

2-halobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-halobenzoic acid or derivatives - Benzamide - Benzoyl - O-quinomethane - Quinomethane - Chlorobenzene - Halobenzene - Toluene - Aryl chloride - Aryl halide - Vinylogous amide - Vinylogous halide - Semicarbazide - Pyrazoline - Secondary carboxylic acid amide - Cyclic ketone - Ketone - Carboxamide group - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 2-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 2-position of the benzene ring.

External Descriptors

Not available

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