Compound Identification
SMILES
[Zr++].CCC(CC)C(=O)C=C(O)C(F)(F)F.CCC(CC)C(=O)C=C(O)C(F)(F)F.[N-]1C2=NC3=NC(=NC4=C5C=CC=CC5=C([N-]4)N=C4N=C(N=C1C1=CC=CC=C21)C1=CC=CC=C41)C1=CC=CC=C31
InChIKey
InChIKey=LBUPWTNOUFXZSQ-UHFFFAOYSA-N
Formula
C50H42F6N8O4Zr
Mass
1024.152
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Tetrapyrroles and derivatives
- Subclass Phthalocyanines
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Class
Tetrapyrroles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Tetrapyrroles and derivatives
Subclass
Phthalocyanines
Intermediate Tree Nodes
Not available
Direct Parent
Phthalocyanines
Alternative Parents
Isoindoles Benzenoids Vinylogous acids Pyrroles Acryloyl compounds Enones Heteroaromatic compounds Ketones Azacyclic compounds Enols Organic transition metal salts Organic metal halides Organic zwitterions Alkyl fluorides Organonitrogen compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Not available
Substituents
Phthalocyanine skeleton - Isoindole - Isoindole or derivatives - Benzenoid - Acryloyl-group - Enone - Pyrrole - Alpha,beta-unsaturated ketone - Vinylogous acid - Heteroaromatic compound - Ketone - Enol - Azacycle - Organic transition metal salt - Organic metal halide - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organic salt - Organic oxygen compound - Organic nitrogen compound - Alkyl fluoride - Carbonyl group - Organic oxide - Alkyl halide - 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