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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Furofurans
- Subclass Isosorbides
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Class
Furofurans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Furofurans
Subclass
Isosorbides
Intermediate Tree Nodes
Not available
Direct Parent
Isosorbides
Alternative Parents
Pyridinecarboxylic acids Dihydropyridinecarboxylic acids and derivatives Vinylogous amides Thiolactams Oxolanes Alkyl nitrates Heteroaromatic compounds Carboxylic acid esters Organic nitro compounds Organic nitric acids and derivatives Oxacyclic compounds Azacyclic compounds Dialkyl ethers Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organonitrogen compounds Organosulfur compounds
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