Structure Information
Structure

Compound Identification

SMILES

[Ni++].CCC1=NC2=C3[N-]C(N=C4N=C(N=C5[N-]C(=NC6=NC(=N3)C3=C6N=C(CC)C(CC)=N3)C3=C(C=CC(=C53)C3=CC=CC=C3)C3=CC=CC=C3)C3=C(C=CC(=C43)C3=CC=CC=C3)C3=CC=CC=C3)=C2N=C1CC

InChIKey

InChIKey=LQKKIJDPXVBRBC-UHFFFAOYSA-N

Formula

C60H44N12Ni

Mass

991.789

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isoindoles and derivatives

Subclass

Isoindoles

Intermediate Tree Nodes

Not available

Direct Parent

Isoindoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Isoindole - Benzenoid - Pyrazine - Monocyclic benzene moiety - Heteroaromatic compound - Pyrrole - Azacycle - Organic transition metal salt - Organic nitrogen compound - Hydrocarbon derivative - Organic salt - Organic zwitterion - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoindoles. These are heteropolycyclic compounds with a structure containing isoindole, a benzo-fused pyrrole.

External Descriptors

Not available

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