Compound Identification
SMILES
CC(OC1=CC=C(NC2=C(C=C(C=C2)C(F)(F)F)[N+]([O-])=O)C=C1)\C=C\C(O)=O
InChIKey
InChIKey=FPOYWPHSZNWSKP-XNWCZRBMSA-N
Formula
C18H15F3N2O5
Mass
396.322
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
Aminophenyl ethers Nitrobenzenes Phenoxy compounds Aniline and substituted anilines Nitroaromatic compounds Alkyl aryl ethers Primary aromatic amines Amino acids Secondary amines Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic zwitterions Alkyl fluorides Organofluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Trifluoromethylbenzene - Aminophenyl ether - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - Primary aromatic amine - Amino acid or derivatives - C-nitro compound - Amino acid - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic oxoazanium - Amine - Organofluoride - Organohalogen compound - Organic oxygen compound - Alkyl fluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Alkyl halide - Carbonyl group - Organic nitrogen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Aromatic homomonocyclic 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