Compound Identification
SMILES
C[C@@H]1N[C@H](CNC(=O)C2=C(NC3=CC=CC(=C3)C(F)(F)F)N=CC=C2)[C@@H](O)[C@H](O)[C@@H]1O
InChIKey
InChIKey=NIKMOTVNTYXGMW-XOPBCEHWSA-N
Formula
C20H23F3N4O4
Mass
440.423
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
Nicotinamides Aniline and substituted anilines Aminopyridines and derivatives Piperidines Imidolactams Vinylogous amides Heteroaromatic compounds Secondary carboxylic acid amides Secondary alcohols 1,2-aminoalcohols 1,2-diols Amino acids and derivatives Dialkylamines Azacyclic compounds Hydrocarbon derivatives Alkyl fluorides Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Pyridinecarboxamide - Pyridine carboxylic acid or derivatives - Nicotinamide - Aniline or substituted anilines - Aminopyridine - Imidolactam - Piperidine - Pyridine - Vinylogous amide - Heteroaromatic compound - Carboxamide group - 1,2-aminoalcohol - Amino acid or derivatives - Secondary carboxylic acid amide - Secondary alcohol - 1,2-diol - Azacycle - Carboxylic acid derivative - Secondary aliphatic amine - Organoheterocyclic compound - Secondary amine - Polyol - Alkyl fluoride - Alcohol - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl halide - Amine - 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