Structure Information
Structure

Compound Identification

SMILES

CN1C=NC(=C1[C@@H](Cl)C(=O)OC(C)(C)C)[N+]([O-])=O

InChIKey

InChIKey=WSHVVBHPPSBQBH-ZCFIWIBFSA-N

Formula

C10H14ClN3O4

Mass

275.69

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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

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitroaromatic compound - Imidazolyl carboxylic acid derivative - Nitroimidazole - N-substituted imidazole - Imidolactam - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organic oxoazanium - Organic nitrogen compound - Organohalogen compound - Organochloride - Alkyl halide - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Alkyl chloride - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic zwitterion - Organic salt - 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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