Structure Information
Structure

Compound Identification

SMILES

OC(=O)CCC(CCC(O)=O)(C#N)S(=O)(=O)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=LDBNAVPGDFJTLO-UHFFFAOYSA-N

Formula

C14H14ClNO6S

Mass

359.78

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzenesulfonyl compounds

Intermediate Tree Nodes

Not available

Direct Parent

Benzenesulfonyl compounds

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Benzenesulfonyl group - Medium-chain fatty acid - Branched fatty acid - Chlorobenzene - Halobenzene - Halogenated fatty acid - Thia fatty acid - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Fatty acyl - Fatty acid - Sulfonyl - Sulfone - Carboxylic acid derivative - Carboxylic acid - Carbonitrile - Nitrile - Carbonyl group - Organohalogen compound - Organic oxide - Cyanide - Organic oxygen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzenesulfonyl compounds. These are aromatic compounds containing a benzenesulfonyl group, which consists of a monocyclic benzene moiety that carries a sulfonyl group.

External Descriptors

Not available

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