Structure Information
Structure

Compound Identification

SMILES

COC(=O)C=CC(N=CC1=CC=CC=C1)(C#N)C#N

InChIKey

InChIKey=BNKLTFHOSGNCPM-UHFFFAOYSA-N

Formula

C14H11N3O2

Mass

253.261

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Fatty acid esters

Intermediate Tree Nodes

Not available

Direct Parent

Fatty acid esters

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Fatty acid ester - Monocyclic benzene moiety - Benzenoid - Methyl ester - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Shiff base - Aldimine - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carbonyl group - Organic nitrogen compound - Imine - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Cyanide - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid.

External Descriptors

Not available

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