Compound Identification
SMILES
Cl.CC(C)(CO)NC(CO)C1=CC(=C(N)C(Br)=C1)C(F)(F)F
InChIKey
InChIKey=PKWIILHELNAHHW-UHFFFAOYSA-N
Formula
C13H19BrClF3N2O2
Mass
407.66
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-bromoanilines Bromobenzenes Aralkylamines Aryl bromides 1,2-aminoalcohols Dialkylamines Primary amines Primary alcohols Organofluorides Organobromides Hydrochlorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Trifluoromethylbenzene - 2-bromoaniline - Aniline or substituted anilines - Bromobenzene - Halobenzene - Aralkylamine - Aryl bromide - Aryl halide - 1,2-aminoalcohol - Secondary amine - Secondary aliphatic amine - Hydrochloride - Organooxygen compound - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Organic oxygen compound - Primary alcohol - Organic nitrogen compound - Alcohol - Primary amine - Amine - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Aromatic homomonocyclic 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