Structure Information
Structure

Compound Identification

SMILES

O=C(CN1CCCC1)C1=CC=C(C=C1)C#N

InChIKey

InChIKey=VRJRRBXAVNDDBX-UHFFFAOYSA-N

Formula

C13H14N2O

Mass

214.268

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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

Benzoyl derivatives Benzonitriles Aryl alkyl ketones N-alkylpyrrolidines Alpha-amino ketones Trialkylamines Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alkyl-phenylketone - Benzonitrile - Benzoyl - Aryl alkyl ketone - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - Alpha-aminoketone - Pyrrolidine - Tertiary amine - Tertiary aliphatic amine - Azacycle - Nitrile - Carbonitrile - Organoheterocyclic compound - Organic nitrogen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Amine - Aromatic heteromonocyclic 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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