Compound Identification
SMILES
COC1=C(CNC2C(CCO)CNC2C2=CC=CC=C2)C=C(CO)C=C1
InChIKey
InChIKey=JPBZRIPXYFSIBE-UHFFFAOYSA-N
Formula
C21H28N2O3
Mass
356.466
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
Phenylmethylamines Phenoxy compounds Methoxybenzenes Benzylamines Benzyl alcohols Anisoles Aralkylamines Alkyl aryl ethers Pyrroles Dialkylamines Azacyclic compounds Primary alcohols Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Anisole - Benzyl alcohol - Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Benzenoid - Pyrrole - Azacycle - Secondary amine - Secondary aliphatic amine - Ether - Aromatic alcohol - Hydrocarbon derivative - Amine - Organic nitrogen compound - Primary alcohol - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Alcohol - Aromatic heteromonocyclic 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