Structure Information
Structure

Compound Identification

SMILES

NCCCCN1C=C(C2=CC=CC=C12)C1=C(NC(=O)N1C1=CC=C(C=C1)[N+]([O-])=O)C#N

InChIKey

InChIKey=LVVQELXFMFSUJR-UHFFFAOYSA-N

Formula

C22H20N6O3

Mass

416.441

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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

N-alkylindoles Indoles Nitrobenzenes Nitroaromatic compounds Substituted pyrroles N-substituted imidazoles Heteroaromatic compounds Ureas Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Nitriles Organic oxides Monoalkylamines Organic salts Hydrocarbon derivatives Organic zwitterions Organooxygen compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-phenylimidazole - N-alkylindole - Indole - Indole or derivatives - Nitrobenzene - Nitroaromatic compound - Monocyclic benzene moiety - N-substituted imidazole - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Pyrrole - C-nitro compound - Organic nitro compound - Urea - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carbonitrile - Nitrile - Azacycle - Organic oxoazanium - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Primary amine - Organic oxide - Primary aliphatic amine - Cyanide - Organic oxygen compound - Organic salt - Organic nitrogen compound - Aromatic heteropolycyclic 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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