Compound Identification
SMILES
CN=C(NC1=CC2=C(OCO2)C=C1)S[C@H]1CC(=O)N(C1=O)C1=CC=C(C=C1)C([O-])=O
InChIKey
InChIKey=BRAAOBUYJNEWEB-INIZCTEOSA-M
Formula
C20H16N3O6S
Mass
426.42
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
Phenylpyrrolidines Benzoic acids Benzodioxoles Benzoyl derivatives Pyrrolidine-2-ones N-substituted carboxylic acid imides Pyrroles Dicarboximides Lactams Isothioureas Carboxylic acid salts Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Sulfenyl compounds Acetals Oxacyclic compounds Organopnictogen compounds Carbonyl compounds Hydrocarbon derivatives Imines Organic oxides Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - 1-phenylpyrrolidine - Benzodioxole - Benzoic acid - Benzoyl - Carboxylic acid imide, n-substituted - 2-pyrrolidone - Pyrrolidone - Dicarboximide - Carboxylic acid imide - Pyrrolidine - Pyrrole - Isothiourea - Lactam - Carboxylic acid salt - Sulfenyl compound - Organoheterocyclic compound - Carboxylic acid - Azacycle - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Acetal - Organic nitrogen compound - Organic oxygen compound - Imine - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic anion - 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