Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=C(C=C1)C(=O)C1CCN(CC1)C1=NC(=NC(=N1)C#N)N1CCOCC1

InChIKey

InChIKey=QBVCDJOMJPOECH-UHFFFAOYSA-N

Formula

C20H21ClN6O2

Mass

412.88

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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 heteromonocyclic compounds

Substituents

Alkyl-phenylketone - 2,4-diamine-s-triazine - Aryl alkyl ketone - Dialkylarylamine - Benzoyl - Amino-1,3,5-triazine - Aminotriazine - Halobenzene - Chlorobenzene - Morpholine - 1,3,5-triazine - Monocyclic benzene moiety - Aryl halide - Benzenoid - Triazine - Piperidine - Oxazinane - Gamma-aminoketone - Aryl chloride - Heteroaromatic compound - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkyl ether - Ether - Carbonitrile - Nitrile - Cyanide - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - 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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