Structure Information
Structure

Compound Identification

SMILES

CNC1=NC(NN\C=C2/C=CC=C(C2=O)[N+]([O-])=O)=NC(NC2=CC=CC=C2)=N1

InChIKey

InChIKey=MMICEEWHCNYPFK-ZHACJKMWSA-N

Formula

C17H16N8O3

Mass

380.368

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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

Aromatic heteromonocyclic compounds

Substituents

O-quinomethane - Aniline or substituted anilines - 2,4-diamine-s-triazine - Secondary aliphatic/aromatic amine - N-aliphatic s-triazine - Amino-1,3,5-triazine - Aminotriazine - 1,3,5-triazine - Monocyclic benzene moiety - Benzenoid - Triazine - Vinylogous amide - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Secondary amine - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Azacycle - Organic nitrogen compound - Organonitrogen compound - Amine - Organic zwitterion - Hydrazine derivative - Organic salt - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic 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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