Compound Identification
SMILES
CCOC(=O)C1=C(N)N(C(C)=C(C1C1=CC=C(C=C1)C#N)C(C)=O)C1=CC=CC(=C1)C(F)(F)F
InChIKey
InChIKey=YQFZOZQVKJGHCI-UHFFFAOYSA-N
Formula
C25H22F3N3O3
Mass
469.464
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 Benzonitriles Vinylogous amides Enoate esters Ketones Ketene acetals Nitriles Monocarboxylic acids and derivatives Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Amines Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Dihydropyridinecarboxylic acid derivative - Benzonitrile - Dihydropyridine - Hydropyridine - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Carboxylic acid ester - Ketene acetal or derivatives - Ketone - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Nitrile - Carbonitrile - Organooxygen compound - Organohalogen compound - Amine - Alkyl halide - Organic oxide - Cyanide - Organic oxygen compound - Alkyl fluoride - Organofluoride - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - 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