Structure Information
Structure

Compound Identification

SMILES

CC1=C(CC2=CC=CC=C2Cl)C(=O)N=C(N1)SCC(=O)NC1=CC(=CC(=C1)C([O-])=O)[N+]([O-])=O

InChIKey

InChIKey=JBHSQJWDXDKGNN-UHFFFAOYSA-M

Formula

C21H16ClN4O6S

Mass

487.89

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Acylaminobenzoic acid or derivatives - Nitrobenzoate - Benzoic acid - Nitrobenzene - Anilide - Aryl thioether - Nitroaromatic compound - Benzoyl - N-arylamide - Chlorobenzene - Halobenzene - Pyrimidone - Alkylarylthioether - Aryl chloride - Aryl halide - Pyrimidine - Hydropyrimidine - Vinylogous amide - Heteroaromatic compound - Organic nitro compound - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - C-nitro compound - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Sulfenyl compound - Carboxylic acid - Thioether - Organic oxoazanium - Organosulfur compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organic salt - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Organonitrogen compound - Organic cation - 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

Previous Back Next