Structure Information
Structure

Compound Identification

SMILES

CC(C[N+]1(C)CCCC1)C(=O)OCC[N+](C)(C)C

InChIKey

InChIKey=DPISUAWPLWZQEC-UHFFFAOYSA-N

Formula

C14H30N2O2

Mass

258.405

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic nitrogen compounds

Class

Organonitrogen compounds

Subclass

Quaternary ammonium salts

Intermediate Tree Nodes

Cholines

Direct Parent

Acyl cholines

Alternative Parents

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

Acyl choline - N-alkylpyrrolidine - Tetraalkylammonium salt - Pyrrolidine - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Amine - Carbonyl group - Organic cation - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as acyl cholines. These are acylated derivatives of choline. Choline or 2-Hydroxy-N,N,N-trimethylethanaminium is a quaternary ammonium salt with the chemical formula (CH3)3N+(CH2)2OH.

External Descriptors

Not available

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