Compound Identification
SMILES
COC1=C(OC)C=C(CCN2C(=O)C(CC(=O)NC3=CC=C(C=C3)C(O)=O)SC2=NC2=CC=CC=C2)C=C1
InChIKey
InChIKey=YCZJAESECQMHHN-UHFFFAOYSA-N
Formula
C28H27N3O6S
Mass
533.6
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
Dimethoxybenzenes Anilides Benzoic acids Phenoxy compounds N-arylamides Benzoyl derivatives Anisoles Alkyl aryl ethers Thiazolidines Isothioureas Secondary carboxylic acid amides Carboxylic acids Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - O-dimethoxybenzene - Dimethoxybenzene - Benzoic acid - Anilide - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Methoxybenzene - N-arylamide - Alkyl aryl ether - Thiazolidine - Carboxamide group - Isothiourea - Secondary carboxylic acid amide - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Ether - Organoheterocyclic compound - Azacycle - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - 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