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Structure Information
Structure

Compound Identification

SMILES

F[C@H]1C[C@H]2CC(F)=CC3=CC(=CC(=C1)N23)C#N

InChIKey

InChIKey=CMNKEXDPAONAKD-RNCFNFMXSA-N

Formula

C13H10F2N2

Mass

232.234

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Alkaloids and derivatives

Class

9b-azaphenalenes

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

9b-azaphenalenes

Alternative Parents

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

9b-azaphenalene skeleton - Dihydropyridine - Tetrahydropyridine - Tertiary amine - Tertiary aliphatic amine - Enamine - Carbonitrile - Nitrile - Azacycle - Vinyl fluoride - Vinyl halide - Fluoroalkene - Organoheterocyclic compound - Haloalkene - Organofluoride - Organonitrogen compound - Cyanide - Hydrocarbon derivative - Amine - Organic nitrogen compound - Alkyl fluoride - Alkyl halide - Organohalogen compound - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 9b-azaphenalenes. These are alkaloids with a structure based on the perhydro-9b-azaphenalene skeleton. Perhydro-9b-azaphenalene is a tricyclic compound consisting of quinolizidine that share its only nitrogen atom with a piperidine. In some 9b-azaphenalenes, the resulting tricyclic backbone can be unsaturated.

External Descriptors

Not available

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