Structure Information
Structure

Compound Identification

SMILES

COC1=CC(Cl)=C(OCCCCCCN2C=NC(=C2)[N+]([O-])=O)C=C1

InChIKey

InChIKey=YQOQUWKMKMGJGX-UHFFFAOYSA-N

Formula

C16H20ClN3O4

Mass

353.8

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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

Phenoxy compounds Anisoles Methoxybenzenes Nitroaromatic compounds Alkyl aryl ethers Chlorobenzenes Aryl chlorides Imidolactams N-substituted imidazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic salts Organonitrogen compounds Hydrocarbon derivatives Organochlorides Organic oxides Organic cations

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Anisole - Nitroimidazole - Phenol ether - Methoxybenzene - Nitroaromatic compound - Phenoxy compound - Chlorobenzene - Halobenzene - Alkyl aryl ether - Monocyclic benzene moiety - Aryl chloride - Imidolactam - Aryl halide - N-substituted imidazole - Benzenoid - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Azacycle - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxide - Organic oxygen compound - Organic salt - Organic nitrogen compound - Organohalogen compound - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - 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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