Structure Information
Structure

Compound Identification

SMILES

[O-]C(=O)C1=CC(=CC(=C1)S([O-])(=O)=O)[N+]([O-])=O

InChIKey

InChIKey=ZRPMYHWMBFITIP-UHFFFAOYSA-L

Formula

C7H3NO7S

Mass

245.16

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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

3-sulfobenzoic acids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

3-sulfobenzoic acid - Nitrobenzoate - Nitrobenzene - 1-sulfo,2-unsubstituted aromatic compound - Benzoic acid - Benzenesulfonyl group - Benzoic acid or derivatives - Arylsulfonic acid or derivatives - Nitroaromatic compound - Benzoyl - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic nitro compound - C-nitro compound - Carboxylic acid salt - Carboxylic acid derivative - Organic oxoazanium - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as 3-sulfobenzoic acids. These are sulfobenzoic acid carrying the sulfonyl group at the 3-position of the benzene group.

External Descriptors

Not available

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