Structure Information
Structure

Compound Identification

SMILES

[Na+].CC1=CC(OCC([O-])=O)=NC(N1)=C1C=CC(=O)C=C1

InChIKey

InChIKey=JIXYPTJNFRWTGG-UHFFFAOYSA-M

Formula

C13H11N2NaO4

Mass

282.231

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones - Quinomethanes

Direct Parent

P-quinomethanes

Alternative Parents

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

P-quinomethane - Hydropyrimidine - 1,2-dihydropyrimidine - Imidolactone - Carboxylic acid salt - Imido ester - Ketene acetal or derivatives - Azacycle - Organic alkali metal salt - Carboxylic acid - Enamine - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Organic zwitterion - Amine - Organic salt - Organic sodium salt - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as p-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 4, respectively.

External Descriptors

Not available

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