Structure Information
Structure

Compound Identification

SMILES

[O-]C(=O)C=CC1=CN=CN1

InChIKey

InChIKey=LOIYMIARKYCTBW-UHFFFAOYSA-M

Formula

C6H5N2O2

Mass

137.119

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Imidazoles

Intermediate Tree Nodes

Substituted imidazoles

Direct Parent

Imidazolyl carboxylic acids and derivatives

Alternative Parents

Heteroaromatic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic anions

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Imidazolyl carboxylic acid derivative - Heteroaromatic compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic anion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as imidazolyl carboxylic acids and derivatives. These are organic compounds containing a carboxylic acid chain (of at least 2 carbon atoms) linked to an imidazole ring.

External Descriptors

CHEBI:27247 : imidazolyl carboxylic acid anion
META CYC (UROCANATE) : a small molecule

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