Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)C1=CC2=C3NC(N=C4NC(=NC5=NC(=NC6=NC(=N3)C3=C6C=C(C=C3)C(C)(C)C)C3=C5C=CC(=C3)C(C)(C)C)C3=C4C=CC(\C=C\C4=CC=C(C=C4)[N+]([O-])=O)=C3)=C2C=C1

InChIKey

InChIKey=AXEFKPFXLDRTGO-ZHACJKMWSA-N

Formula

C52H47N9O2

Mass

830.009

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Tetrapyrroles and derivatives

Subclass

Phthalocyanines

Intermediate Tree Nodes

Not available

Direct Parent

Phthalocyanines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phthalocyanine skeleton - Stilbene - Isoindole - Isoindole or derivatives - Nitrobenzene - Nitroaromatic compound - Styrene - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Pyrrole - C-nitro compound - Organic nitro compound - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic nitrogen compound - Organic salt - Organic oxygen compound - Organic oxide - Organic zwitterion - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phthalocyanines. These are cyclic tetrapyrroles that contain a phthalocyanine skeleton, which consists of four isoindole-type units, with the connecting carbon atoms in the macrocycle replaced by nitrogen.

External Descriptors

Not available

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