Compound Identification
SMILES
O=C1[C@@H]2C[C@H](CC[C@H]2[C@@]2(OC[C@H]3[C@H]4CC[C@H](C4)[C@H]3N12)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=NTEXUUKYSBKMGJ-IAIYRYBLSA-N
Formula
C28H31NO2
Mass
413.561
Taxonomic Classification
Taxonomy Tree
-
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
Isoindolones Aromatic monoterpenoids Pyrrolidine-2-ones N-alkylpyrrolidines Benzene and substituted derivatives 1,3-oxazinanes Tertiary carboxylic acid amides Pyrroles Lactams Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Aromatic monoterpenoid - Isoindolone - Norbornane monoterpenoid - Monoterpenoid - Isoindoline - Isoindole or derivatives - 1,3-oxazinane - Monocyclic benzene moiety - Oxazinane - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Pyrrole - Tertiary carboxylic acid amide - Lactam - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - 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