Compound Identification
SMILES
COC(=O)C1=CC=CC=C1NC(=O)CN1N=NC(=N1)C1=CC(=CC=C1)C(F)(F)F
InChIKey
InChIKey=JSEHMXBIIAGPNU-UHFFFAOYSA-N
Formula
C18H14F3N5O3
Mass
405.337
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
Phenyltetrazoles and derivatives Trifluoromethylbenzenes Benzoic acid esters Anilides Benzoyl derivatives N-arylamides Vinylogous amides Methyl esters Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Phenyltetrazole - Benzoate ester - Trifluoromethylbenzene - Anilide - Benzoyl - N-arylamide - Azole - Heteroaromatic compound - Tetrazole - Vinylogous amide - Methyl ester - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic 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