Structure Information
Structure

Compound Identification

SMILES

COC(=O)CC1C2CC(Cl)(C#N)C1C=C2

InChIKey

InChIKey=KTDSTYGSVPCSGD-UHFFFAOYSA-N

Formula

C11H12ClNO2

Mass

225.67

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Carboxylic acid derivatives

Intermediate Tree Nodes

Carboxylic acid esters

Direct Parent

Methyl esters

Alternative Parents

Molecular Framework

Aliphatic homopolycyclic compounds

Substituents

Methyl ester - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Cyanide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Alkyl halide - Aliphatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as methyl esters. These are organic compounds containing a carboxyl group that is esterified with a methyl group. They have the general structure RC(=O)OR', where R=H or organyl group and R'=methyl group.

External Descriptors

Not available

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