Structure Information
Structure

Compound Identification

SMILES

NC1=NC(=C\C(N1)=C1/C=C(C=CC1=O)C1=NC(N)=NC=C1)N1CCNCC1

InChIKey

InChIKey=IISUQDYKQRXLTK-OWBHPGMISA-N

Formula

C18H20N8O

Mass

364.413

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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 - Aminopyrimidine - 1,4-diazinane - Hydropyrimidine - 1,6-dihydropyrimidine - Piperazine - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Ketene acetal or derivatives - Guanidine - Carboximidamide - Secondary amine - Organoheterocyclic compound - Azacycle - Secondary aliphatic amine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Primary amine - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - 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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