Structure Information
Structure

Compound Identification

SMILES

CC(=O)NC1=C(C=C(N2C=CN=C2)C(=C1)N1C=CN=C1)[N+]([O-])=O

InChIKey

InChIKey=QNPNAQDVAWMWDI-UHFFFAOYSA-N

Formula

C14H12N6O3

Mass

312.289

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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

Acetanilides N-acetylarylamines Nitrobenzenes Nitroaromatic compounds N-substituted imidazoles Acetamides Heteroaromatic compounds Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic salts Organic zwitterions Hydrocarbon derivatives Carbonyl compounds Organic oxides

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

1-phenylimidazole - Acetanilide - Nitrobenzene - N-acetylarylamine - Anilide - Nitroaromatic compound - N-arylamide - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Acetamide - Heteroaromatic compound - Organic nitro compound - Carboxamide group - Secondary carboxylic acid amide - C-nitro compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Organic salt - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic zwitterion - Organic nitrogen compound - 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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