Compound Identification
SMILES
C[N+](C)(C)CCOC(=O)CCl
InChIKey
InChIKey=ZIVCANCSXUNYHM-UHFFFAOYSA-N
Formula
C7H15ClNO2
Mass
180.65
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
-
Class
Organonitrogen compounds
-
Subclass
Quaternary ammonium salts
-
Level 5
Cholines
- Level 6 Acyl cholines
-
Level 5
Cholines
-
Subclass
Quaternary ammonium salts
-
Class
Organonitrogen compounds
-
Superclass
Organic nitrogen compounds
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Quaternary ammonium salts
Intermediate Tree Nodes
Cholines
Direct Parent
Acyl cholines
Alternative Parents
Tetraalkylammonium salts Alpha-halocarboxylic acid derivatives Carboxylic acid esters Monocarboxylic acids and derivatives Organopnictogen compounds Organochlorides Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds Amines Alkyl chlorides Organic cations
Molecular Framework
Aliphatic acyclic compounds
Substituents
Acyl choline - Alpha-halocarboxylic acid derivative - Alpha-halocarboxylic acid or derivatives - Tetraalkylammonium salt - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organooxygen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Amine - Organic oxide - Organopnictogen compound - Alkyl halide - Alkyl chloride - Organic salt - Organic cation - Aliphatic acyclic 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