Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(NC(NC2=CC=C(C)C=C2)=N\C(N)=N\[NH+](O)[O-])C=C1

InChIKey

InChIKey=JMBOFNRBGVXKDA-UHFFFAOYSA-N

Formula

C16H20N6O2

Mass

328.376

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic nitrogen compounds

Class

Organonitrogen compounds

Subclass

Guanidines

Intermediate Tree Nodes

Biguanides - Arylbiguanides

Direct Parent

1-arylbiguanides

Alternative Parents

Toluenes Propargyl-type 1,3-dipolar organic compounds Organic zwitterions Organic salts Organic oxides Imines Hydrocarbon derivatives

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

1-arylbiguanide - Toluene - Benzenoid - Monocyclic benzene moiety - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic zwitterion - Imine - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as 1-arylbiguanides. These are organonitrogen compounds containing a biguanide that is N-arylsubstituted at only the 1-position.

External Descriptors

Not available

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