Compound Identification
SMILES
Cl.FC(F)(F)C1=CC=CC(C(=O)NC(C2CCCN2CC=C)C2=CC=CC=N2)=C1Cl
InChIKey
InChIKey=RJEOOZIQIHEEDC-UHFFFAOYSA-N
Formula
C21H22Cl2F3N3O
Mass
460.32
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-halobenzoic acids and derivatives Benzamides Benzoyl derivatives Aralkylamines Chlorobenzenes Pyridines and derivatives Aryl chlorides N-alkylpyrrolidines Vinylogous halides Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Hydrochlorides Organic oxides Organochlorides Organofluorides Alkyl fluorides Organooxygen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Chlorobenzene - Halobenzene - Aralkylamine - Aryl chloride - Aryl halide - Pyridine - N-alkylpyrrolidine - Pyrrolidine - Vinylogous halide - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Amine - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organofluoride - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Hydrochloride - 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