Compound Identification
SMILES
NC(CO)(CO)CCC1=CC(=C(OCCCC2=C(O)C=CC(Cl)=C2)C=C1)C(F)(F)F
InChIKey
InChIKey=IILPWCBICLMXSJ-UHFFFAOYSA-N
Formula
C21H25ClF3NO4
Mass
447.88
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
Phenoxy compounds Phenol ethers P-chlorophenols Chlorobenzenes Aralkylamines Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides 1,2-aminoalcohols Primary alcohols Organofluorides Organochlorides Monoalkylamines Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Trifluoromethylbenzene - Phenoxy compound - Phenol ether - 4-chlorophenol - 4-halophenol - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Aralkylamine - Chlorobenzene - Phenol - Halobenzene - Aryl chloride - Aryl halide - 1,2-aminoalcohol - Ether - Organic nitrogen compound - Organochloride - Organohalogen compound - Primary aliphatic amine - Organofluoride - Organonitrogen compound - Organooxygen compound - Primary alcohol - Primary amine - Hydrocarbon derivative - Amine - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Alcohol - 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