Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CN(CC2CO2)C(I)=N1

InChIKey

InChIKey=XLQZRRHJSQFHQZ-UHFFFAOYSA-N

Formula

C6H6IN3O3

Mass

295.036

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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

1,2,4-trisubstituted imidazoles Nitroaromatic compounds Aryl iodides Imidolactams N-substituted imidazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Dialkyl ethers Epoxides Organic oxoazanium compounds Hydrocarbon derivatives Organonitrogen compounds Organoiodides Organopnictogen compounds Organic oxides

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

1,2,4-trisubstituted-imidazole - Nitroaromatic compound - Nitroimidazole - Trisubstituted imidazole - Aryl halide - Aryl iodide - N-substituted imidazole - Imidolactam - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Azacycle - Oxacycle - Dialkyl ether - Oxirane - Ether - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxygen compound - Organohalogen compound - Hydrocarbon derivative - Organoiodide - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxide - Organic nitrogen compound - 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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