Compound Identification
SMILES
CCOC(=O)[C@@H]1[C@@H](C2=CC=CC=C2C(F)(F)F)C(C(=O)OCC)=C(C)N\C1=C/C(=O)C(F)(F)F
InChIKey
InChIKey=JTCPRPVYIUZCOY-MPYBMCPGSA-N
Formula
C22H21F6NO5
Mass
493.402
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
Tetrahydropyridines Dicarboxylic acids and derivatives Vinylogous amides Enones Enoate esters Alpha-haloketones Acryloyl compounds Amino acids and derivatives Enamines Dialkylamines Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Tetrahydropyridine - Dicarboxylic acid or derivatives - Hydropyridine - Alpha-haloketone - Acryloyl-group - Enone - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Amino acid or derivatives - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Azacycle - Organoheterocyclic compound - Secondary amine - Amine - Alkyl halide - Hydrocarbon derivative - Alkyl fluoride - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organohalogen compound - 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