Structure Information
Structure

Compound Identification

SMILES

OC(CCC(O)=O)C1=CC=C(C=C1)C1=NC=CN1

InChIKey

InChIKey=GJMJHGKBPGRVNO-UHFFFAOYSA-N

Formula

C13H14N2O3

Mass

246.266

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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

Phenylimidazoles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-phenylimidazole - Imidazolyl carboxylic acid derivative - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Secondary alcohol - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Hydrocarbon derivative - Aromatic alcohol - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Alcohol - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylimidazoles. These are polycyclic aromatic compounds containing a benzene ring linked to an imidazole ring through a CC or CN bond.

External Descriptors

Not available

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