Compound Identification
SMILES
COC(=O)C1=C(O)C=C(NC(=O)C(C)(O)C(F)(F)F)C=C1
InChIKey
InChIKey=BPQNKAPPWWAQHP-UHFFFAOYSA-N
Formula
C12H12F3NO5
Mass
307.225
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Acylaminobenzoic acid and derivatives
Alternative Parents
o-Hydroxybenzoic acid esters Salicylic acid and derivatives Anilides Benzoyl derivatives N-arylamides 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Methyl esters Vinylogous acids Tertiary alcohols Fluorohydrins Secondary carboxylic acid amides Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - O-hydroxybenzoic acid ester - Benzoate ester - Salicylic acid or derivatives - Anilide - N-arylamide - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Vinylogous acid - Methyl ester - Tertiary alcohol - Carboxylic acid ester - Halohydrin - Secondary carboxylic acid amide - Carboxamide group - Fluorohydrin - Carboxylic acid derivative - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Alcohol - Organic oxide - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Organofluoride - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.
External Descriptors
Not available