Structure Information
Structure

Compound Identification

SMILES

CC1=C(C)C=C(C=CC2=NC=C(N2CCO)[N+]([O-])=O)C=C1

InChIKey

InChIKey=PGSMKQTUHVMUHG-UHFFFAOYSA-N

Formula

C15H17N3O3

Mass

287.319

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Azoles

Subclass

Imidazoles

Intermediate Tree Nodes

Substituted imidazoles

Direct Parent

Nitroimidazoles

Alternative Parents

o-Xylenes Styrenes Nitroaromatic compounds 1,2,5-trisubstituted imidazoles N-substituted imidazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Alkanolamines Primary alcohols Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

1,2,5-trisubstituted-imidazole - Nitroaromatic compound - Nitroimidazole - Styrene - O-xylene - Xylene - Trisubstituted imidazole - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Alkanolamine - Azacycle - Organic oxoazanium - Organic salt - Organooxygen compound - Organonitrogen compound - Primary alcohol - Organic oxygen compound - Organic oxide - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic zwitterion - 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

Previous Back Next