Structure Information
Structure

Compound Identification

SMILES

CC(=O)NC1=C(C=CC(=C1)S(O)(=O)=O)C(O)=O

InChIKey

InChIKey=QNDMAZMTITWLDT-UHFFFAOYSA-N

Formula

C9H9NO6S

Mass

259.23

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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

Not available

Direct Parent

Acylaminobenzoic acid and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

4-sulfobenzoic acid - Acylaminobenzoic acid or derivatives - Sulfobenzoic acid - Acetanilide - Benzenesulfonate - N-acetylarylamine - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Benzoic acid - Anilide - 1-sulfo,2-unsubstituted aromatic compound - Benzoyl - N-arylamide - Acetamide - Vinylogous amide - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid - Carboxylic acid derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.

External Descriptors

Not available

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