Compound Identification
SMILES
[Ni++].O=C(C1=NC(=C(C2=C3CCCCC3=C([N-]2)C(=C2N=C(C(=C3[N-]C(=O)C4=C3CCCC4)C3=CC=CC=C3)C3=C2CCCC3)C2=CC=CC=C2)C2=CC=CC=C2)C2=C1CCCC2)C1=CC=CC=C1
InChIKey
InChIKey=QAFVFFUNUITSCE-UHFFFAOYSA-L
Formula
C60H52N4NiO2
Mass
919.795
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Tetrapyrroles and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetrapyrroles and derivatives
Alternative Parents
Isoindolones Isoindoles Aryl ketones Benzoyl derivatives Substituted pyrroles Pyrrolines Heteroaromatic compounds Lactams Ketimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carbene-type 1,3-dipolar compounds Organic transition metal salts Carboxylic acids and derivatives Organic zwitterions Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tetrapyrrole skeleton - Isoindolone - Isoindole - Isoindole or derivatives - Benzoyl - Aryl ketone - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Pyrroline - Pyrrole - Ketimine - Ketone - Lactam - Organic 1,3-dipolar compound - Carbene-type 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic transition metal salt - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Imine - Carbonyl group - Organic zwitterion - Organic salt - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetrapyrroles and derivatives. These are polycyclic aromatic compounds containing four pyrrole rings joined by one-carbon units linking position 2 of one pyrrole ring to position 5 of the next.
External Descriptors
Not available