Compound Identification
SMILES
CC[NH+](CC)CCN1C(C(=C([O-])C2=CC(C)=C(OCC(C)C)C=C2)C(=O)C1=O)C1=CC=C(O)C=C1
InChIKey
InChIKey=RBRBTWICXYSCKU-UHFFFAOYSA-N
Formula
C28H36N2O5
Mass
480.605
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
Phenol ethers Phenoxy compounds Alkyl aryl ethers Toluenes 1-hydroxy-2-unsubstituted benzenoids N-alkylpyrrolidines Pyrrolidine-3-ones Pyrrolidine-2-ones Vinylogous acids Tertiary carboxylic acid amides Quaternary ammonium salts Pyrroles Amino acids and derivatives Trialkylamines Lactams Cyclic ketones Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenoxy compound - Phenol ether - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Toluene - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Vinylogous acid - Pyrrole - Tertiary carboxylic acid amide - Quaternary ammonium salt - Tertiary aliphatic amine - Cyclic ketone - Carboxamide group - Ketone - Lactam - Amino acid or derivatives - Tertiary amine - Ether - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic salt - Organic zwitterion - Organic oxide - Hydrocarbon derivative - Amine - Organic nitrogen compound - Carbonyl group - 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