Structure Information
Structure

Compound Identification

SMILES

OC(=O)C1COCN1C(=O)C1=CC=CC=C1SSC1=CC=CC=C1C(=O)N1COCC1C(O)=O

InChIKey

InChIKey=QOCPPXMIERMWEN-UHFFFAOYSA-N

Formula

C22H20N2O8S2

Mass

504.53

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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

Direct Parent

O-sulfanylbenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Alpha-amino acid or derivatives - O-sulfanylbenzoic acid or derivatives - Benzamide - Benzoyl - Dicarboxylic acid or derivatives - Oxazolidine - Tertiary carboxylic acid amide - Carboxamide group - Organic disulfide - Carboxylic acid derivative - Carboxylic acid - Oxacycle - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Organic oxide - Aromatic heteromonocyclic compound

Description

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

External Descriptors

Not available

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