Compound Identification
SMILES
COC1=C(O)C=CC(C=CC2C3=CCC4C(C3CC3C(=O)N(NC5=C(Cl)C=C(C=N5)C(F)(F)F)C(=O)C23C2=CC=C(Cl)C=C2)C(=O)N(C4=O)C2=CC=C(C=C)C=C2)=C1
InChIKey
InChIKey=LRJPKKIAMMYDFU-UHFFFAOYSA-N
Formula
C43H33Cl2F3N4O6
Mass
829.65
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Isoindolones Methoxyphenols Styrenes Methoxybenzenes Phenoxy compounds Anisoles Chlorobenzenes 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Pyrrolidine-2-ones Imidolactams Pyridines and derivatives Aryl chlorides N-substituted carboxylic acid imides Pyrroles Dicarboximides Heteroaromatic compounds Carboxylic acid hydrazides Lactams Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Alkyl fluorides Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - 3-phenylpyrrolidine - Methoxyphenol - Isoindolone - Isoindole or derivatives - Isoindoline - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Styrene - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Chlorobenzene - Phenol - Halobenzene - Pyridine - Pyrrolidone - 2-pyrrolidone - Benzenoid - Imidolactam - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Carboxylic acid imide, n-substituted - Heteroaromatic compound - Carboxylic acid imide - Dicarboximide - Pyrrole - Lactam - Carboxylic acid hydrazide - Carboxylic acid derivative - Ether - Azacycle - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organofluoride - Organonitrogen compound - Organochloride - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrolidine ring through a CC or CN bond. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
External Descriptors
Not available