Structure Information
Structure

Compound Identification

SMILES

COC(=O)CCC1=CC=C(C=C1)C(Cl)CN=[N+]=[N-]

InChIKey

InChIKey=TWKUPJKJITUALW-UHFFFAOYSA-N

Formula

C12H14ClN3O2

Mass

267.71

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Fatty Acyls

Subclass

Fatty acid esters

Intermediate Tree Nodes

Not available

Direct Parent

Fatty acid esters

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Fatty acid ester - Monocyclic benzene moiety - Benzenoid - Methyl ester - Azo compound - Azo imide - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Alkyl chloride - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid.

External Descriptors

Not available

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