Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(=CC1=CC(=CN(C)C)C(=O)O1)C(C)=O

InChIKey

InChIKey=KWRXRTMQQARFPI-UHFFFAOYSA-N

Formula

C14H17NO5

Mass

279.292

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Keto acids and derivatives

Subclass

Beta-keto acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Beta-keto acids and derivatives

Alternative Parents

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

Beta-keto acid - Fatty acid ester - Dicarboxylic acid or derivatives - Alpha-branched alpha,beta-unsaturated-ketone - Fatty acyl - Acryloyl-group - Dihydrofuran - Enol ester - Enone - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Alpha,beta-unsaturated ketone - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Lactone - Ketone - Oxacycle - Organoheterocyclic compound - Allylamine - Carboxylic acid derivative - Enamine - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Amine - Organonitrogen compound - Organic oxide - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as beta-keto acids and derivatives. These are organic compounds containing an aldehyde substituted with a keto group on the C3 carbon atom.

External Descriptors

Not available

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