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Structure Information
Structure

Compound Identification

SMILES

CCC[N+]1(CCC(C1C([O-])=S)C1=CC=CC=C1)C(=O)C(=O)C1CCCCC1

InChIKey

InChIKey=QAYLKHCHMDHHKT-UHFFFAOYSA-N

Formula

C22H29NO3S

Mass

387.54

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolidines

Subclass

Phenylpyrrolidines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrrolidines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

3-phenylpyrrolidine - N-acylpyrrolidine - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - Pyrrole - Quaternary ammonium salt - Carbodithioic acid - Carbothioic o-acid - Ketone - Azacycle - Thiocarboxylic acid - Carboxylic acid derivative - Organic salt - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Thiocarbonyl group - Carbonyl group - Organic cation - 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

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