Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)O[C@@H]1COC2[C@H](COC12)OC(=O)C1=CC=CNC1=S

InChIKey

InChIKey=NVAMVWJODPJNOK-AFWXGSBKSA-N

Formula

C12H12N2O7S

Mass

328.3

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Furofurans

Subclass

Isosorbides

Intermediate Tree Nodes

Not available

Direct Parent

Isosorbides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isosorbide - Dihydropyridinecarboxylic acid derivative - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Dihydropyridine - Hydropyridine - Pyridine - Heteroaromatic compound - Organic nitrate - Oxolane - Thiolactam - Vinylogous amide - Alkyl nitrate - Organic nitro compound - Organic nitric acid or derivatives - Carboxylic acid ester - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Ether - Oxacycle - Dialkyl ether - Carboxylic acid derivative - Azacycle - Organic oxide - Organic nitrogen compound - Organic salt - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isosorbides. These are organic polycyclic compounds containing an isosorbide(1,4-Dianhydrosorbitol) moiety, which consists of two -oxolan-3-ol rings.

External Descriptors

Not available

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