Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(N)N(C(C)=C(C1C1=CC=C(C=C1)C#N)C(C)=O)C1=CC=CC(=C1)C(F)(F)F

InChIKey

InChIKey=YQFZOZQVKJGHCI-UHFFFAOYSA-N

Formula

C25H22F3N3O3

Mass

469.464

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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 - Dihydropyridinecarboxylic acid derivative - Benzonitrile - Dihydropyridine - Hydropyridine - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Carboxylic acid ester - Ketene acetal or derivatives - Ketone - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Nitrile - Carbonitrile - Organooxygen compound - Organohalogen compound - Amine - Alkyl halide - Organic oxide - Cyanide - Organic oxygen compound - Alkyl fluoride - Organofluoride - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen 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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