Compound Identification
SMILES
CC(=O)NC1=CC=C(C=C1)C(=O)OCC(=O)C(\C#N)=C(/C)N
InChIKey
InChIKey=KHBXESNSGYYMHH-UKTHLTGXSA-N
Formula
C15H15N3O4
Mass
301.302
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
Acetanilides Benzoic acid esters N-acetylarylamines Benzoyl derivatives Alpha-branched alpha,beta-unsaturated ketones Acetamides Vinylogous amides Acryloyl compounds Enones Carboxylic acid esters Amino acids and derivatives Secondary carboxylic acid amides Ketones Enamines Nitriles Organic oxides Hydrocarbon derivatives Monoalkylamines
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Acetanilide - Benzoate ester - N-acetylarylamine - Anilide - Benzoyl - N-arylamide - Alpha-branched alpha,beta-unsaturated-ketone - Acryloyl-group - Enone - Acetamide - Vinylogous amide - Alpha,beta-unsaturated ketone - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Ketone - Secondary carboxylic acid amide - Carbonitrile - Enamine - Carboxylic acid derivative - Nitrile - Primary aliphatic amine - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Amine - Carbonyl group - Organic oxide - Cyanide - Organonitrogen compound - Organooxygen compound - Primary amine - 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