Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(=C/C1=CC=C(SC)C=C1)\C#N

InChIKey

InChIKey=WANKHEREZAPKJP-FLIBITNWSA-N

Formula

C13H13NO2S

Mass

247.31

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Cinnamic acids and derivatives

Subclass

Cinnamic acid esters

Intermediate Tree Nodes

Not available

Direct Parent

Cinnamic acid esters

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Cinnamic acid ester - Thiophenol ether - Aryl thioether - Fatty acid ester - Alkylarylthioether - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Carboxylic acid derivative - Sulfenyl compound - Monocarboxylic acid or derivatives - Thioether - Carbonitrile - Nitrile - Cyanide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid.

External Descriptors

Not available

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