Structure Information
Structure

Compound Identification

SMILES

C[C@H](O)CC1=C(C)C2=CC(Cl)=C(OCC(=O)C3=CC=C(C)C=C3)C=C2OC1=O

InChIKey

InChIKey=UMSXFYYGSCOOPW-ZDUSSCGKSA-N

Formula

C22H21ClO5

Mass

400.86

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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 heteropolycyclic compounds

Substituents

Alkyl-phenylketone - Coumarin - Benzopyran - 1-benzopyran - Benzoyl - Aryl alkyl ketone - Alkyl aryl ether - Toluene - Pyranone - Benzenoid - Aryl chloride - Pyran - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Secondary alcohol - Lactone - Oxacycle - Ether - Organoheterocyclic compound - Hydrocarbon derivative - Alcohol - Organic oxide - Organohalogen compound - Organochloride - Aromatic heteropolycyclic 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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