Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(C=C1)C1=NC(OCC(=O)C2=CC=C(Cl)C=C2)=C(C#N)C(=C1)C(F)(F)F

InChIKey

InChIKey=ALHJXJOPLGIZHZ-UHFFFAOYSA-N

Formula

C22H14ClF3N2O3

Mass

446.81

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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-phenylpyridine - Anisole - Benzoyl - Phenol ether - Aryl alkyl ketone - 3-pyridinecarbonitrile - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl halide - Benzenoid - Pyridine - Aryl chloride - Monocyclic benzene moiety - Heteroaromatic compound - Organoheterocyclic compound - Azacycle - Ether - Carbonitrile - Nitrile - Organonitrogen compound - Alkyl fluoride - Alkyl halide - Organic nitrogen compound - Organic oxide - Organofluoride - Hydrocarbon derivative - Cyanide - Organohalogen compound - Organochloride - 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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