Structure Information
Structure

Compound Identification

SMILES

OC1=C(C=CC(NS(=O)(=O)C2=CC=CS2)=C1)C(=O)OCC(=O)NC1=NC=C(S1)[N+]([O-])=O

InChIKey

InChIKey=BDWRHJIHAWSJMS-UHFFFAOYSA-N

Formula

C16H12N4O8S3

Mass

484.47

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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

Benzoic acid esters

Direct Parent

o-Hydroxybenzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

O-hydroxybenzoic acid ester - Sulfanilide - Salicylic acid or derivatives - Nitroaromatic compound - N-arylamide - Benzoyl - Nitrothiazole - 2,5-disubstituted 1,3-thiazole - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Organosulfonic acid amide - Vinylogous acid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Thiophene - Sulfonyl - Thiazole - Azole - Aminosulfonyl compound - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxoazanium - Organic zwitterion - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Organic salt - Organosulfur compound - Organic oxide - Carbonyl group - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-hydroxybenzoic acid esters. These are benzoic acid esters where the benzene ring is ortho-substituted with a hydroxy group.

External Descriptors

Not available

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