Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(=CC1=CC=C(O1)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C#N

InChIKey

InChIKey=WCNBYSYJSYTJQN-UHFFFAOYSA-N

Formula

C18H11F6NO3

Mass

403.28

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Trifluoromethylbenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Trifluoromethylbenzenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Trifluoromethylbenzene - Fatty acid ester - Fatty acyl - Furan - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organoheterocyclic compound - Oxacycle - Organofluoride - Organohalogen compound - Carbonyl group - Alkyl halide - Cyanide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Alkyl fluoride - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.

External Descriptors

Not available

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