Structure Information
Structure

Compound Identification

SMILES

CC(C)(CNC=C1C=C(C=CC1=O)[N+]([O-])=O)N=CC1=CC(C=CC1=O)=[N+](O)[O-]

InChIKey

InChIKey=LQCKTHBNNAIIGA-UHFFFAOYSA-N

Formula

C18H18N4O6

Mass

386.364

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones - Quinomethanes

Direct Parent

O-quinomethanes

Alternative Parents

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

O-quinomethane - Vinylogous amide - C-nitro compound - Nitronic acid - Shiff base - Organic nitro compound - Allylamine - Secondary aliphatic amine - Enamine - Aldimine - Organic oxoazanium - Secondary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Hydrocarbon derivative - Organonitrogen compound - Imine - Amine - Organic zwitterion - Organic oxide - Organic nitrogen compound - Organic salt - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.

External Descriptors

Not available

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