Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1=CC=CC=C1SC(SC1=CC=CC=C1C(O)=O)C1=CC(Cl)=CC=C1

InChIKey

InChIKey=JWHODDNUTOXGCB-UHFFFAOYSA-N

Formula

C21H15ClO4S2

Mass

430.92

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

Sulfanylbenzoic acids and derivatives - O-sulfanylbenzoic acids and derivatives

Direct Parent

O-sulfanylbenzoic acids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

O-sulfanylbenzoic acid - Benzoic acid - Aryl thioether - Benzoyl - Thiophenol ether - Alkylarylthioether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Vinylogous thioester - Dicarboxylic acid or derivatives - Thioacetal - Sulfenyl compound - Carboxylic acid derivative - Carboxylic acid - Thioether - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-sulfanylbenzoic acids. These are benzoic acids which bear a sulfanyl group (R-SH) attached to the benzene ring at positions 1 and 2, respectively.

External Descriptors

Not available

Previous Back Next