Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C2=C3C(NC(=O)C(O)(CC(=O)C4=CC=CC=C4)C3=CC(Cl)=N2)=C1

InChIKey

InChIKey=OJXPOFORGKOUPG-UHFFFAOYSA-N

Formula

C21H17ClN2O5

Mass

412.83

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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 - Haloquinoline - Quinolone - Chloroquinoline - Diazanaphthalene - Quinoline - Naphthyridine - Anisole - Benzoyl - Aryl alkyl ketone - Alkyl aryl ether - 2-halopyridine - Beta-hydroxy ketone - Benzenoid - Monocyclic benzene moiety - Pyridine - Aryl halide - Aryl chloride - Heteroaromatic compound - Tertiary alcohol - Lactam - Carboxamide group - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organochloride - Organohalogen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organonitrogen compound - 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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