Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1CC(N2C=CC=C(C#N)C12)C(=O)C1=CC=CC=C1

InChIKey

InChIKey=VYIBKKZVEFVSOF-UHFFFAOYSA-N

Formula

C18H16N2O3

Mass

308.337

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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 - Benzoyl - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Aryl alkyl ketone - Dihydropyridine - Monocyclic benzene moiety - Benzenoid - Alpha-aminoketone - Pyrrolidine - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Tertiary amine - Tertiary aliphatic amine - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Enamine - Allylamine - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Organic oxide - Cyanide - Organic nitrogen 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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