Compound Identification
SMILES
CC1=CC(C(=O)COC(=O)C2=CC=C(C=C2)N2CCCC2=O)=C(C)C=C1
InChIKey
InChIKey=XNCGGNPSSASFOE-UHFFFAOYSA-N
Formula
C21H21NO4
Mass
351.402
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
Alkyl-phenylketones Phenylpyrrolidines Benzoic acid esters p-Xylenes Benzoyl derivatives Aryl alkyl ketones Pyrrolidine-2-ones Tertiary carboxylic acid amides Pyrroles Lactams Carboxylic acid esters Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Alkyl-phenylketone - 1-phenylpyrrolidine - Benzoate ester - Phenylketone - Benzoyl - P-xylene - Xylene - Aryl ketone - Aryl alkyl ketone - Pyrrolidone - 2-pyrrolidone - Pyrrole - Tertiary carboxylic acid amide - Pyrrolidine - Carboxamide group - Carboxylic acid ester - Ketone - Lactam - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - 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