Compound Identification
SMILES
CN1C(CN2C[C@H]3C(CNC4=C(C=CC(=C4)C(F)(F)F)C(F)(F)F)[C@H]3C2)=NC2=CC=CC=C12
InChIKey
InChIKey=ZGHBYHBGPGDHAN-MQVJKMGUSA-N
Formula
C23H22F6N4
Mass
468.447
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
Benzimidazoles Phenylalkylamines Aniline and substituted anilines Secondary alkylarylamines Piperidines N-substituted imidazoles N-alkylpyrrolidines Heteroaromatic compounds Trialkylamines Azacyclic compounds Organopnictogen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Benzimidazole - Aniline or substituted anilines - Phenylalkylamine - Secondary aliphatic/aromatic amine - Aralkylamine - N-substituted imidazole - Piperidine - N-alkylpyrrolidine - Heteroaromatic compound - Pyrrolidine - Azole - Imidazole - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Secondary amine - Amine - Organofluoride - Organohalogen compound - Alkyl fluoride - Organonitrogen compound - Organic nitrogen compound - Alkyl halide - Hydrocarbon derivative - Organopnictogen 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