Structure Information
Structure

Compound Identification

SMILES

Cl.CCN(CCCCC(O)=O)C1=C(CN(CC2=CC(=CC(=C2)C#N)C(F)(F)F)C2=CC(C)=NO2)C=C2CCCC2=C1

InChIKey

InChIKey=PGXRTOONPBFOQJ-UHFFFAOYSA-N

Formula

C30H34ClF3N4O3

Mass

591.07

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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 heteropolycyclic compounds

Substituents

Trifluoromethylbenzene - Indane - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Benzylamine - Benzonitrile - Heteroaromatic compound - Isoxazole - Azole - Tertiary amine - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Oxacycle - Azacycle - Carboxylic acid - Carbonitrile - Organoheterocyclic compound - Nitrile - Monocarboxylic acid or derivatives - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrochloride - Hydrocarbon derivative - Carbonyl group - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - Aromatic heteropolycyclic 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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