Structure Information
Structure

Compound Identification

SMILES

COCCN1N=NN=C1C(N1CCC(=CC1)C1=CC=C(F)C=C1)C1=CC=C(C=C1)C(F)(F)F

InChIKey

InChIKey=BPSLAFGHXAPHDC-UHFFFAOYSA-N

Formula

C23H23F4N5O

Mass

461.465

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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 - Fluorobenzene - Aralkylamine - Halobenzene - Aryl fluoride - Aryl halide - Hydropyridine - Azole - Heteroaromatic compound - Tetrazole - Tertiary aliphatic amine - Tertiary amine - Dialkyl ether - Ether - Azacycle - Organoheterocyclic compound - Amine - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organohalogen compound - Organofluoride - 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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