Structure Information
Structure

Compound Identification

SMILES

CN1NC(=N\C1=C1\C=C(C=CC1=O)[N+]([O-])=O)C1=C(C)C=CC=N1

InChIKey

InChIKey=FFKJTRTZFPLYHQ-RVDMUPIBSA-N

Formula

C15H13N5O3

Mass

311.301

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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 - Methylpyridine - Pyridine - Imidolactam - Triazoline - Heteroaromatic compound - Vinylogous amide - Carboxylic acid amidrazone - Ketene acetal or derivatives - C-nitro compound - Organic nitro compound - Amidine - Azacycle - Organic oxoazanium - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organonitrogen compound - Organic oxide - Organic zwitterion - Hydrocarbon derivative - Organic nitrogen compound - Organic salt - 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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