Compound Identification
SMILES
OC(=O)[C@H]1CCCC[C@@H]1C(=O)NC1=C(NC2=CC=C(C=C2)C#N)C=CC(=C1)C(F)(F)F
InChIKey
InChIKey=VUCMJYOWXXAQBZ-IRXDYDNUSA-N
Formula
C22H20F3N3O3
Mass
431.415
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Trifluoromethylbenzenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Trifluoromethylbenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Trifluoromethylbenzenes
Alternative Parents
2'-Aminoanilides Aniline and substituted anilines Benzonitriles N-arylamides Primary aromatic amines Secondary carboxylic acid amides Amino acids Secondary amines Nitriles Carboxylic acids Monocarboxylic acids and derivatives Alkyl fluorides Carbonyl compounds Organofluorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Trifluoromethylbenzene - 2'-aminoanilide - Anilide - Benzonitrile - N-arylamide - Aniline or substituted anilines - Primary aromatic amine - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Amino acid - Carboxylic acid derivative - Secondary amine - Carboxylic acid - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Amine - Alkyl halide - Carbonyl group - Organic nitrogen compound - Cyanide - Organic oxide - Alkyl fluoride - Aromatic homomonocyclic 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