Compound Identification
SMILES
Cl[In].FC(F)(F)C1=CC=CC(=C1)C1=C2[N-]C(N=C3N=C(N=C4[N-]C(=NC5=NC(=N2)C2=CC=CC=C52)C2=CC=CC=C42)C2=CC=CC=C32)=C1C1=CC(=CC=C1)C(F)(F)F
InChIKey
InChIKey=MDFMDDALAOQHEO-UHFFFAOYSA-M
Formula
C42H20ClF6InN8
Mass
900.94
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
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Subclass
Substituted pyrroles
- Level 5 Phenylpyrroles
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Subclass
Substituted pyrroles
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Class
Pyrroles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Substituted pyrroles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrroles
Alternative Parents
Trifluoromethylbenzenes Isoindoles Heteroaromatic compounds Organic metal salts Azacyclic compounds Organonitrogen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyrrole - Trifluoromethylbenzene - Isoindole - Isoindole or derivatives - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Azacycle - Organic metal salt - Organic nitrogen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organic anion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrroles. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrole ring through a CC or CN bond.
External Descriptors
Not available