Compound Identification
SMILES
CC(CC1=CC2=C(OC(O2)(C(O)=O)C(O)=O)C=C1)NCC(O)C1=CC=CC=C1C(F)(F)F
InChIKey
InChIKey=YCBFARZPXVXVEE-UHFFFAOYSA-N
Formula
C21H20F3NO7
Mass
455.386
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
Benzodioxoles Aralkylamines Ketals Dicarboxylic acids and derivatives Secondary alcohols 1,2-aminoalcohols Amino acids Oxacyclic compounds Dialkylamines Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Aromatic alcohols Organic oxides Organofluorides Alkyl fluorides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Trifluoromethylbenzene - Benzodioxole - Ketal - Aralkylamine - Dicarboxylic acid or derivatives - 1,2-aminoalcohol - Amino acid or derivatives - Amino acid - Secondary alcohol - Acetal - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Carboxylic acid - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Aromatic alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Amine - Alkyl halide - Alkyl fluoride - Alcohol - Organic oxygen 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