Structure Information
Structure

Compound Identification

SMILES

CC1=NC=C(N1CCNC=CC#N)[N+]([O-])=O

InChIKey

InChIKey=GHGVRJQJWUXLMJ-UHFFFAOYSA-N

Formula

C9H11N5O2

Mass

221.22

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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

Nitroimidazoles

Alternative Parents

Nitroaromatic compounds 1,2,5-trisubstituted imidazoles N-substituted imidazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Nitriles Enamines Dialkylamines Azacyclic compounds Allylamines Organic salts Organic oxides Hydrocarbon derivatives Organic cations

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

1,2,5-trisubstituted-imidazole - Nitroaromatic compound - Nitroimidazole - Trisubstituted imidazole - N-substituted imidazole - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Secondary aliphatic amine - Enamine - Carbonitrile - Nitrile - Organic oxoazanium - Allylamine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Amine - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Cyanide - Organic salt - Hydrocarbon derivative - Organic oxide - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitroimidazoles. These are compounds containing an imidazole ring which bears a nitro group.

External Descriptors

Not available

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