Compound Identification
SMILES
OCC1=C(OC=N1)C1=CC(Cl)=C(N=C1)C1=CCN(CC1)C1=CC(Cl)=C(C=C1)C(F)(F)F
InChIKey
InChIKey=ZGKLLXCTABXOLT-UHFFFAOYSA-N
Formula
C21H16Cl2F3N3O2
Mass
470.27
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
Dialkylarylamines Aniline and substituted anilines Chlorobenzenes 4,5-disubstituted oxazoles Hydropyridines Aryl chlorides Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Primary alcohols Organofluorides Organochlorides Hydrocarbon derivatives Aromatic alcohols Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - 4,5-disubstituted 1,3-oxazole - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Hydropyridine - Pyridine - Azole - Heteroaromatic compound - Oxazole - Tertiary amine - Organoheterocyclic compound - Oxacycle - Azacycle - Primary alcohol - Organofluoride - Organochloride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Alkyl halide - Alkyl fluoride - Aromatic alcohol - 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