Structure Information
Structure

Compound Identification

SMILES

COC(OC)[C@]1(C)OC2=C(C=C(N)C=C2)[C@H]([C@@H]1O)N(CC1=NC=CN1)C1=CC=C(C=C1)C(F)(F)F

InChIKey

InChIKey=VJYLHVYFQVOBLB-FUPPJEDESA-N

Formula

C24H27F3N4O4

Mass

492.499

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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

Chromane - Benzopyran - Trifluoromethylbenzene - 1-benzopyran - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Alkyl aryl ether - Aralkylamine - Primary aromatic amine - Azole - Imidazole - Heteroaromatic compound - Tertiary amine - Secondary alcohol - 1,2-aminoalcohol - Azacycle - Organoheterocyclic compound - Oxacycle - Ether - Acetal - Alcohol - Organohalogen compound - Organofluoride - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Amine - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Primary amine - Hydrocarbon derivative - 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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