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Structure Information
Structure

Compound Identification

SMILES

CC[N+]1(CCCC1(C(S)=O)C1=CC=CC=C1)C(=O)C(=O)C1CCCCC1

InChIKey

InChIKey=AEQBGHYOWGDLBZ-UHFFFAOYSA-O

Formula

C21H28NO3S

Mass

374.52

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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

2-phenylpyrrolidine - Alpha-amino acid or derivatives - N-acylpyrrolidine - Pyrrolidine carboxylic acid or derivatives - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Pyrrole - Quaternary ammonium salt - Carbodithioic acid - Carbothioic s-acid - Ketone - Carboxylic acid derivative - Alkylthiol - Azacycle - Thiocarboxylic acid or derivatives - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - 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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