Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(CC(=O)C1=CC=C(C=C1)S(C)(=O)=O)C(=O)OC

InChIKey

InChIKey=IPQROFYLPCTTFL-UHFFFAOYSA-N

Formula

C14H16O7S

Mass

328.34

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones - Phenylketones

Direct Parent

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Alkyl-phenylketone - Butyrophenone - Benzenesulfonyl group - Benzoyl - Aryl alkyl ketone - Gamma-keto acid - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - 1,3-dicarbonyl compound - Dicarboxylic acid or derivatives - Keto acid - Methyl ester - Sulfonyl - Sulfone - Carboxylic acid ester - Carboxylic acid derivative - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

External Descriptors

Not available

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