Structure Information
Structure

Compound Identification

SMILES

COC1=C(COC(=O)C=CC2=CC(OC)=C(OC)C(Cl)=C2)C=C(C=C1)C(C)=O

InChIKey

InChIKey=GDOPTZGPBSQSJY-UHFFFAOYSA-N

Formula

C21H21ClO6

Mass

404.84

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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

Direct Parent

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Alkyl-phenylketone - Coumaric acid or derivatives - Cinnamic acid or derivatives - Cinnamic acid ester - O-dimethoxybenzene - Dimethoxybenzene - Benzyloxycarbonyl - Acetophenone - Phenoxy compound - Phenol ether - Styrene - Methoxybenzene - Aryl alkyl ketone - Benzoyl - Anisole - Chlorobenzene - Fatty acid ester - Halobenzene - Alkyl aryl ether - Fatty acyl - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - Organochloride - Organohalogen 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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