Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=C(C=C1)C(=O)COC(=O)\C=C\C1=NC2=CC=CC=C2S1

InChIKey

InChIKey=UXQCTOBJIGBVIU-MDZDMXLPSA-N

Formula

C18H12ClNO3S

Mass

357.81

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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 - 1,3-benzothiazole - Benzoyl - Aryl alkyl ketone - Alpha-acyloxy ketone - Fatty acid ester - Halobenzene - Chlorobenzene - Monocyclic benzene moiety - Fatty acyl - Aryl chloride - Benzenoid - Aryl halide - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Thiazole - Azole - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organochloride - Organohalogen compound - Hydrocarbon derivative - 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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