Compound Identification
SMILES
OCC1=CC=C(O1)C1C2=CCC3C(C2CC2C(=O)N(NC4=C(Cl)C=C(C=N4)C(F)(F)F)C(=O)C12C1=CC=C(Cl)C=C1)C(=O)N(C3=O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=DBFATEYBISCLSG-UHFFFAOYSA-N
Formula
C37H26Cl3F3N4O6
Mass
785.98
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
-
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
Isoindolones Chlorobenzenes Pyridines and derivatives Aryl chlorides Imidolactams N-substituted carboxylic acid imides Pyrrolidine-2-ones Pyrroles Dicarboximides Furans Heteroaromatic compounds Carboxylic acid hydrazides Lactams Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organochlorides Organofluorides Organonitrogen compounds Alkyl fluorides Primary alcohols Carbonyl compounds Organic oxides Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - 3-phenylpyrrolidine - Isoindolone - Isoindoline - Isoindole or derivatives - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - Pyridine - Carboxylic acid imide - Dicarboximide - Furan - Heteroaromatic compound - Pyrrole - Carboxylic acid hydrazide - Lactam - Carboxylic acid derivative - Oxacycle - Azacycle - Primary alcohol - Aromatic alcohol - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen 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