Structure Information
Structure

Compound Identification

SMILES

CCOCC1=C(C=CC(C(=O)C2C(=O)CCCC2=O)=C1Cl)S(C)(=O)=O

InChIKey

InChIKey=NJVOFUFNFBOHJW-UHFFFAOYSA-N

Formula

C17H19ClO6S

Mass

386.84

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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 - Alkyl-phenylketones

Direct Parent

Benzoylcyclohexane-1,3-diones

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Benzoylcyclohexane-1,3-dione - Benzenesulfonyl group - Benzylether - Benzoyl - Aryl alkyl ketone - Chlorobenzene - Halobenzene - 1,3-diketone - 1,3-dicarbonyl compound - Aryl halide - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Sulfonyl - Sulfone - Vinylogous halide - Cyclic ketone - Ether - Dialkyl ether - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organochloride - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzoylcyclohexane-1,3-diones. These are alkyl-phenylketones where the alkyl group is a cyclohexane 1,3-dione.

External Descriptors

Not available

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