Structure Information
Structure

Compound Identification

SMILES

CC1=NC=C(N1CCOC(=O)NC(NC1=CC=C(Br)C=C1)C(Cl)(Cl)Cl)[N+]([O-])=O

InChIKey

InChIKey=OXYUSYVDYMFJAQ-UHFFFAOYSA-N

Formula

C15H15BrCl3N5O4

Mass

515.57

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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

1,2,5-trisubstituted imidazoles Phenylalkylamines Nitroaromatic compounds Bromobenzenes Aryl bromides N-substituted imidazoles Heteroaromatic compounds Carbamate esters Organic oxoazanium compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Organobromides Alkyl chlorides Hydrocarbon derivatives Carbonyl compounds Organochlorides Organic salts Organic zwitterions

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

1,2,5-trisubstituted-imidazole - Nitroaromatic compound - Nitroimidazole - Trisubstituted imidazole - Phenylalkylamine - Bromobenzene - Halobenzene - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - N-substituted imidazole - Heteroaromatic compound - Carbamic acid ester - Organic nitro compound - C-nitro compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Hydrocarbon derivative - Organobromide - Organohalogen compound - Organic oxygen compound - Organochloride - Organonitrogen compound - Alkyl chloride - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organic oxide - Organic zwitterion - Alkyl halide - 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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