Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=CC=CC(C(O)=O)=C1NS(=O)(=O)C1=CC(=CC=C1)S(=O)(=O)NC1=C(C=CC(=C1C(O)=O)S(O)(=O)=O)C(O)=O

InChIKey

InChIKey=DNUKTKFXJPALOA-UHFFFAOYSA-N

Formula

C22H16N2O15S3

Mass

644.55

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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

4-sulfobenzoic acids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

2-sulfobenzoic acid - 4-sulfobenzoic acid - Meta_phthalic_acid - Benzenesulfonamide - Sulfanilide - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Benzoic acid or derivatives - Benzoic acid - 1-sulfo,2-unsubstituted aromatic compound - Benzoyl - Organosulfonic acid amide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organosulfonic acid - Vinylogous amide - Aminosulfonyl compound - Sulfonyl - Carboxylic acid - Carboxylic acid derivative - Organosulfur compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as 4-sulfobenzoic acids. These are sulfobenzoic acid carrying the sulfonyl group at the 4-position of the benzene group.

External Descriptors

Not available

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