Compound Identification
SMILES
CCOC(=O)C1=C(C)NC(CN2C=CN=C2)=C(C1C1=C(Cl)C(=CC=C1)C(F)(F)F)C(=O)OC
InChIKey
InChIKey=WRCWIZSKMRUGJQ-UHFFFAOYSA-N
Formula
C22H21ClF3N3O4
Mass
483.87
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
Dihydropyridinecarboxylic acids and derivatives Imidazolyl carboxylic acids and derivatives Chlorobenzenes Aryl chlorides Dicarboxylic acids and derivatives N-substituted imidazoles Vinylogous amides Enoate esters Heteroaromatic compounds Methyl esters Enamines Dialkylamines Azacyclic compounds Organic oxides Organochlorides Organofluorides Alkyl fluorides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Dihydropyridinecarboxylic acid derivative - Imidazolyl carboxylic acid derivative - Chlorobenzene - Dihydropyridine - Halobenzene - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Hydropyridine - N-substituted imidazole - Azole - Heteroaromatic compound - Vinylogous amide - Imidazole - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Secondary aliphatic amine - Organoheterocyclic compound - Enamine - Azacycle - Alkyl fluoride - Alkyl halide - Hydrocarbon derivative - Amine - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen 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