Structure Information
Structure

Compound Identification

SMILES

CC1=CC(NC2=NC(=O)C(S2)=CC2=CC=C(O2)C2=CC(C(O)=O)=C(Cl)C=C2)=CC(C)=C1

InChIKey

InChIKey=SWGPWYBLTQZMLJ-UHFFFAOYSA-N

Formula

C23H17ClN2O4S

Mass

452.91

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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

Halobenzoic acids

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-halobenzoic acid - Halobenzoic acid - 2-halobenzoic acid or derivatives - Benzoic acid - Benzoyl - M-xylene - Xylene - Aniline or substituted anilines - 1-carboxy-2-haloaromatic compound - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Vinylogous halide - Meta-thiazoline - Furan - Heteroaromatic compound - Isothiourea - N-acylimine - Organic 1,3-dipolar compound - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Monocarboxylic acid or derivatives - Azacycle - Organooxygen compound - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as halobenzoic acids. These are benzoic acids carrying a halogen atom on the benzene ring.

External Descriptors

Not available

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