Compound Identification
SMILES
CC(C)OC(=O)C1=CC=CC(C2=CC=CC=C2)=C1OC1=C(F)C2=C(C3=NC4=NC(=NC5=C6C(=C(N5)N=C5N=C(N=C2N3)C2=C5C(F)=C(F)C(OC3=C(C=CC=C3C(=O)OC(C)C)C3=CC=CC=C3)=C2F)C(F)=C(OC2=C(C=CC=C2C(=O)OC(C)C)C2=CC=CC=C2)C(F)=C6F)C2=C4C(F)=C(OC3=C(C=CC=C3C(=O)OC(C)C)C3=CC=CC=C3)C(F)=C2F)C(F)=C1F
InChIKey
InChIKey=CCPWWZUBWAEPBU-UHFFFAOYSA-N
Formula
C96H62F12N8O12
Mass
1747.577
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
Biphenyls and derivatives Diarylethers Benzoic acid esters Isoindoles Phenoxy compounds Phenol ethers Benzoyl derivatives Aryl fluorides Pyrroles Heteroaromatic compounds Carboxylic acid esters Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phthalocyanine skeleton - Biphenyl - Diaryl ether - Benzoate ester - Benzoic acid or derivatives - Isoindole - Isoindole or derivatives - Phenol ether - Benzoyl - Phenoxy compound - Aryl halide - Monocyclic benzene moiety - Aryl fluoride - Benzenoid - Heteroaromatic compound - Pyrrole - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organofluoride - Organohalogen compound - Organic oxygen compound - 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