Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=CC(=C1)N1C=NC2=C1N=CN=C2N(CCO)CCO)[N+]([O-])=O

InChIKey

InChIKey=VYABGOCAUSAWSN-UHFFFAOYSA-N

Formula

C16H18N6O4

Mass

358.358

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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

Phenylimidazoles

Alternative Parents

6-alkylaminopurines Nitrotoluenes Nitrobenzenes Nitroaromatic compounds Dialkylarylamines Aminopyrimidines and derivatives N-substituted imidazoles Imidolactams Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Azacyclic compounds Alkanolamines Primary alcohols Organopnictogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

6-alkylaminopurine - 1-phenylimidazole - 6-aminopurine - Nitrotoluene - Purine - Nitrobenzene - Imidazopyrimidine - Nitroaromatic compound - Dialkylarylamine - Toluene - Aminopyrimidine - Imidolactam - Benzenoid - Pyrimidine - N-substituted imidazole - Monocyclic benzene moiety - Heteroaromatic compound - 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 - Alkanolamine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Primary alcohol - Organooxygen compound - Organonitrogen compound - Alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylimidazoles. These are polycyclic aromatic compounds containing a benzene ring linked to an imidazole ring through a CC or CN bond.

External Descriptors

Not available

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