Structure Information
Structure

Compound Identification

SMILES

NC1=CC=CC2=C1C=C1C=CC3=C4C(C=CC2=C14)=CC=C3

InChIKey

InChIKey=CYLGRLTVDYSTRG-UHFFFAOYSA-N

Formula

C20H13N

Mass

267.331

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Pyrenes

Subclass

Benzopyrenes

Intermediate Tree Nodes

Not available

Direct Parent

Benzopyrenes

Alternative Parents

Chrysenes Anthracenes Primary amines Hydrocarbon derivatives

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Benzo-a-pyrene - Chrysene - Phenanthrene - Anthracene - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzopyrenes. These are organic compounds containing a benzene fused to a pyrene(benzo[def]phenanthrene) ring system.

External Descriptors

Not available

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