Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(C(=O)C(=O)NC1=CC=CC=C1C(C)=O)C1=NC2=C(NC1=O)C=C(Cl)C=C2

InChIKey

InChIKey=NWTHLIWIZUXDIM-UHFFFAOYSA-N

Formula

C21H16ClN3O6

Mass

441.82

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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 - Diazanaphthalene - Quinoxaline - Acetophenone - Anilide - Benzoyl - N-arylamide - Aryl alkyl ketone - Beta-keto acid - Fatty acid ester - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty amide - Keto acid - Pyrazine - 1,3-dicarbonyl compound - Benzenoid - Fatty acyl - Vinylogous amide - Methyl ester - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid ester - Lactam - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organochloride - Organopnictogen compound - Organic oxide - Organonitrogen compound - Organic nitrogen compound - Organohalogen 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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