Compound Identification
SMILES
CCOC1=C(OCC(=O)NN=CC2=CC=C(C=C2)C(F)(F)F)C=CC(=C1)C1NC(=O)NC(C)=C1C(=O)OC
InChIKey
InChIKey=CHPOCZCBTSRUBL-UHFFFAOYSA-N
Formula
C25H25F3N4O6
Mass
534.492
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
Hydropyrimidine carboxylic acids and derivatives Phenoxy compounds Phenol ethers Alkyl aryl ethers Pyrimidones Vinylogous amides Enoate esters Methyl esters Ureas Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Trifluoromethylbenzene - Hydropyrimidine carboxylic acid derivative - Phenol ether - Phenoxy compound - Alkyl aryl ether - Pyrimidone - Hydropyrimidine - 1,2,3,4-tetrahydropyrimidine - Pyrimidine - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Carboxylic acid ester - Urea - Carboxylic acid derivative - Ether - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Alkyl halide - Hydrocarbon derivative - Organic nitrogen compound - Alkyl fluoride - Organic oxide - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Carbonyl group - 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