Compound Identification
SMILES
CC1=C(Cl)C=C(C=C1)N1C(=O)C2CC=C3C(CC4C(=O)N(NC5=CC=C(F)C=C5)C(=O)C4(C3C3=CC=C(CO)O3)C3=CC=C(Cl)C=C3)C2C1=O
InChIKey
InChIKey=JJXHUPRUNNFWLO-UHFFFAOYSA-N
Formula
C38H30Cl2FN3O6
Mass
714.57
Taxonomic Classification
Taxonomy Tree
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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 Phenylhydrazines Chlorobenzenes Fluorobenzenes Toluenes Pyrrolidine-2-ones Aryl chlorides N-substituted carboxylic acid imides Aryl fluorides Pyrroles Dicarboximides Furans Heteroaromatic compounds Carboxylic acid hydrazides Lactams Oxacyclic compounds Azacyclic compounds Organic oxides Organochlorides Organofluorides Aromatic alcohols Carbonyl compounds Organonitrogen compounds Primary alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - 3-phenylpyrrolidine - Isoindolone - Isoindoline - Isoindole or derivatives - Phenylhydrazine - Chlorobenzene - Fluorobenzene - Halobenzene - Toluene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Benzenoid - Pyrrolidone - 2-pyrrolidone - Pyrrole - Carboxylic acid imide - Dicarboximide - Furan - Heteroaromatic compound - Carboxylic acid hydrazide - Lactam - Carboxylic acid derivative - Azacycle - Oxacycle - Alcohol - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Organochloride - Organofluoride - Organooxygen compound - Carbonyl group - Aromatic alcohol - Primary alcohol - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - 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