Structure Information
Structure

Compound Identification

SMILES

CC1(C)O[C@H]2O[C@@H]3[C@H](O)[C@@H](CC#N)O[C@@H]3[C@H]2O1

InChIKey

InChIKey=WRJFNYQVZMPRJZ-DAORTFEHSA-N

Formula

C11H15NO5

Mass

241.243

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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

Ketals Monosaccharides Oxolanes 1,3-dioxolanes Secondary alcohols Oxacyclic compounds Nitriles Dialkyl ethers Organopnictogen compounds Hydrocarbon derivatives

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Isosorbide - Ketal - Monosaccharide - Meta-dioxolane - Oxolane - Secondary alcohol - Acetal - Dialkyl ether - Ether - Oxacycle - Carbonitrile - Nitrile - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Cyanide - Organopnictogen compound - Alcohol - Organic oxygen compound - Aliphatic 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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