Compound Identification
SMILES
COC(=O)C1=CC(NC(=O)COC(=O)C2=CC=CC=C2NS(=O)(=O)C2=CC=CC(N)=C2)=C(C=C1)C(=O)OC
InChIKey
InChIKey=XHRUWUOJHZJMKG-UHFFFAOYSA-N
Formula
C25H23N3O9S
Mass
541.53
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
p-Phthalate esters P-phthalic acid and derivatives Aminobenzenesulfonamides Sulfanilides Benzoic acid esters Anilides Benzenesulfonyl compounds Aniline and substituted anilines N-arylamides Benzoyl derivatives Organosulfonamides Vinylogous amides Aminosulfonyl compounds Methyl esters Secondary carboxylic acid amides Amino acids and derivatives Organic oxides Primary amines Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Phthalate ester - Para-phthalic acid ester - Para_phthalic_acid - Aminobenzenesulfonamide - Benzenesulfonamide - Benzoate ester - Sulfanilide - Benzenesulfonyl group - Anilide - Benzoyl - Aniline or substituted anilines - N-arylamide - Organosulfonic acid amide - Vinylogous amide - Methyl ester - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Aminosulfonyl compound - Sulfonyl - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxylic acid derivative - Primary amine - Amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - 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