Compound Identification
SMILES
CC(C)(CNC1=CC=C(C=C1)C1=NNC(=O)CC1)NCC(O)COC1=C(Cl)C=CC(=C1)C(F)(F)F
InChIKey
InChIKey=MTFICIGHFGPMDE-UHFFFAOYSA-N
Formula
C24H28ClF3N4O3
Mass
512.96
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
Phenylalkylamines Phenoxy compounds Phenol ethers Aniline and substituted anilines Secondary alkylarylamines Alkyl aryl ethers Pyridazinones Chlorobenzenes Aryl chlorides 1,2-aminoalcohols Amino acids and derivatives Secondary alcohols Dialkylamines Azacyclic compounds Hydrocarbon derivatives Organochlorides Carbonyl compounds Organofluorides Alkyl fluorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Phenoxy compound - Phenylalkylamine - Aniline or substituted anilines - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Secondary aliphatic/aromatic amine - Pyridazinone - Aryl chloride - Aryl halide - Pyridazine - 1,2-aminoalcohol - Amino acid or derivatives - Secondary alcohol - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Secondary aliphatic amine - Ether - Secondary amine - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Alcohol - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Amine - Organohalogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - 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