Compound Identification
SMILES
C[C@@H](O[C@H]1CN2C(CC(CC2=O)NC(=O)NC2=CC=C(C=C2)C#N)C1C1=CC=C(F)C=C1)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F
InChIKey
InChIKey=IPGJRNCZPJIUMC-MWKJYZASSA-N
Formula
C32H27F7N4O3
Mass
648.582
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Trifluoromethylbenzenes N-phenylureas Benzylethers Indolizidines Benzonitriles Delta lactams Fluorobenzenes Piperidinones Aryl fluorides Pyrroles Tertiary carboxylic acid amides Ureas Azacyclic compounds Dialkyl ethers Nitriles Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyrrolidine - N-phenylurea - Trifluoromethylbenzene - Indolizidine - Benzylether - Benzonitrile - Halobenzene - Piperidinone - Fluorobenzene - Delta-lactam - Aryl halide - Piperidine - Aryl fluoride - Benzenoid - Monocyclic benzene moiety - Pyrrole - Tertiary carboxylic acid amide - Carboxamide group - Urea - Lactam - Nitrile - Carbonitrile - Carboxylic acid derivative - Azacycle - Dialkyl ether - Ether - Organohalogen compound - Alkyl halide - Organooxygen compound - Organonitrogen compound - Alkyl fluoride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Cyanide - Organic oxygen compound - Organic nitrogen compound - Organofluoride - 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