Structure Information
Structure

Compound Identification

SMILES

C[N+]1(C)CC[C@@H](CC(=O)[C@@](O)(C2CCCC2)C2=CSC=C2)C1

InChIKey

InChIKey=AYKCJRTWYYCINY-KBXCAEBGSA-N

Formula

C18H28NO2S

Mass

322.49

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones

Direct Parent

Gamma-amino ketones

Alternative Parents

N-alkylpyrrolidines Acyloins Thiophenes Tetraalkylammonium salts Tertiary alcohols Heteroaromatic compounds Alpha-hydroxy ketones Azacyclic compounds Organic oxides Hydrocarbon derivatives Aromatic alcohols Amines Organic cations

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Acyloin - Gamma-aminoketone - N-alkylpyrrolidine - Alpha-hydroxy ketone - Pyrrolidine - Quaternary ammonium salt - Tertiary alcohol - Thiophene - Tetraalkylammonium salt - Heteroaromatic compound - Organoheterocyclic compound - Azacycle - Amine - Organic nitrogen compound - Alcohol - Aromatic alcohol - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as gamma-amino ketones. These are organic compounds containing a carboxylic acid, and an amine group attached to the C4 carbon atom.

External Descriptors

Not available

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