Compound Identification
SMILES
CC[NH+](CC)CCCN1C(C(=C([O-])C2=CC3=C(OCCO3)C=C2)C(=O)C1=O)C1=CC=C(OCC2=CC=CC=C2)C=C1
InChIKey
InChIKey=WILBKSAMCSNTGS-UHFFFAOYSA-N
Formula
C33H36N2O6
Mass
556.659
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
Benzo-1,4-dioxanes Phenoxy compounds Phenol ethers Alkyl aryl ethers Pyrrolidine-3-ones Pyrrolidine-2-ones Para dioxins N-alkylpyrrolidines Vinylogous acids Tertiary carboxylic acid amides Quaternary ammonium salts Pyrroles Trialkylamines Amino acids and derivatives Cyclic ketones Lactams Oxacyclic compounds Azacyclic compounds Organic salts Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Benzo-1,4-dioxane - Benzodioxane - Phenoxy compound - Phenol ether - Alkyl aryl ether - Para-dioxin - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Tertiary carboxylic acid amide - Quaternary ammonium salt - Pyrrole - Vinylogous acid - Tertiary aliphatic amine - Tertiary amine - Cyclic ketone - Lactam - Amino acid or derivatives - Ketone - Carboxamide group - Oxacycle - Azacycle - Carboxylic acid derivative - Ether - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic salt - Organic zwitterion - 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