Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C12C(CC1(C)OC(=O)C=C2C)C#N

InChIKey

InChIKey=BJORTTXSSGJWKL-UHFFFAOYSA-N

Formula

C13H15NO4

Mass

249.266

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrans

Subclass

Pyranones and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Dihydropyranones

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Dihydropyranone - Dicarboxylic acid or derivatives - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Carbonitrile - Nitrile - Oxacycle - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dihydropyranones. These are compounds containing a hydrogenated pyran ring which bears a ketone, and contains one double bond.

External Descriptors

Not available

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