Compound Identification
SMILES
CCOC(=O)C1=CC=C(C=C1)N=C1SC(CC(=O)N1CC1=CC2=C(OCO2)C=C1)C(=O)NC1=CC=C(C=C1)C(O)=O
InChIKey
InChIKey=YYQAHDQTDJPSJN-UHFFFAOYSA-N
Formula
C29H25N3O8S
Mass
575.59
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
Benzoic acid esters Anilides Benzodioxoles Benzoic acids Benzoyl derivatives N-arylamides Thiazinanes Dicarboxylic acids and derivatives Carboxylic acid esters Secondary carboxylic acid amides Isothioureas Acetals Carboxylic acids Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Benzoate ester - Benzodioxole - Benzoic acid - Anilide - Benzoyl - N-arylamide - Dicarboxylic acid or derivatives - 1,3-thiazinane - Carboxamide group - Carboxylic acid ester - Isothiourea - Secondary carboxylic acid amide - Oxacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Acetal - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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