Compound Identification
SMILES
COC1=C(C=C(Cl)C=C1)C1=C2CCCCN=C2N(N1)C1=C(Cl)C=CC(=C1)C(F)(F)F
InChIKey
InChIKey=VRXJNWQCSIIHMZ-UHFFFAOYSA-N
Formula
C21H18Cl2F3N3O
Mass
456.29
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
Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Azepines Chlorobenzenes Imidolactams Aryl chlorides Pyrazolines Amidrazones Amidines Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Alkyl fluorides Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Azepine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Imidolactam - Pyrazoline - Carboxylic acid amidrazone - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Amidine - Azacycle - Organoheterocyclic compound - Ether - Alkyl halide - Organohalogen compound - Hydrocarbon derivative - Alkyl fluoride - Organic nitrogen compound - Organic oxygen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - 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