Structure Information
Structure

Compound Identification

SMILES

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

InChIKey

InChIKey=YPNUYFJLBFZDTE-UHFFFAOYSA-N

Formula

C7H7NO5S

Mass

217.2

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzenesulfonic acids and derivatives

Intermediate Tree Nodes

Sulfobenzoic acids

Direct Parent

2-sulfobenzoic acids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

2-sulfobenzoic acid - Aminobenzoic acid - Aminobenzoic acid or derivatives - Benzenesulfonyl group - Arylsulfonic acid or derivatives - Benzoic acid or derivatives - Benzoic acid - 1-sulfo,2-unsubstituted aromatic compound - Aniline or substituted anilines - Benzoyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid - Amino acid or derivatives - Amino acid - Carboxylic acid - Carboxylic acid derivative - Primary amine - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organooxygen compound - Organosulfur compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as 2-sulfobenzoic acids. These are sulfobenzoic acid carrying the sulfonyl group at the 2-position of the benzene group.

External Descriptors

Not available

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