Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC([N-]S(=O)(=O)C2=CC=CC=C2[N+]([O-])=O)=C(Cl)C=C1

InChIKey

InChIKey=NCTWVEMMLXGHHA-UHFFFAOYSA-N

Formula

C14H10ClN2O6S

Mass

369.75

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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

Benzoic acid esters

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Sulfanilide - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoate ester - Benzenesulfonamide - Benzenesulfonyl group - Nitrobenzene - Benzoyl - Nitroaromatic compound - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Methyl ester - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Carboxylic acid ester - Organic nitro compound - C-nitro compound - Organic oxoazanium - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organochloride - 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 benzoic acid esters. These are ester derivatives of benzoic acid.

External Descriptors

Not available

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