Structure Information
Structure

Compound Identification

SMILES

CCC(=O)C1=CC=C(OCC(=O)[C@H](C#N)C(C)=N)C=C1

InChIKey

InChIKey=DJHSMXBBYSFYMW-CYBMUJFWSA-N

Formula

C15H16N2O3

Mass

272.304

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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 - Phenylpropane - Benzoyl - Phenol ether - Aryl alkyl ketone - Phenoxy compound - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Ketimine - Nitrile - Carbonitrile - Ether - Organic nitrogen compound - Organonitrogen compound - Imine - Hydrocarbon derivative - Organic oxide - Cyanide - 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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