Compound Identification
SMILES
C[C@@H](NCC(=O)NC1=CC=CC=C1C(=O)NC1CC1)C1=CC(=CC=C1)C(F)(F)F
InChIKey
InChIKey=KYIQBATULIXAPX-CYBMUJFWSA-N
Formula
C21H22F3N3O2
Mass
405.421
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
Alpha amino acid amides Trifluoromethylbenzenes Benzamides Anilides N-arylamides Benzoyl derivatives Aralkylamines Vinylogous amides Secondary carboxylic acid amides Dialkylamines Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Trifluoromethylbenzene - Alpha-amino acid or derivatives - Benzamide - Anilide - N-arylamide - Benzoyl - Aralkylamine - Vinylogous amide - Secondary carboxylic acid amide - Carboxamide group - Amino acid or derivatives - Secondary amine - Secondary aliphatic amine - Carboxylic acid derivative - Alkyl fluoride - Organohalogen compound - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - 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