Compound Identification
SMILES
[Cl-].CC([O-])=O.CCC[N+](CCC)(CCC)CC(O)CCl
InChIKey
InChIKey=DVFCWPYBPWNFSX-UHFFFAOYSA-L
Formula
C14H30Cl2NO3
Mass
331.3
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
-
Class
Organonitrogen compounds
-
Subclass
Quaternary ammonium salts
- 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
Not available
Direct Parent
Cholines
Alternative Parents
Tetraalkylammonium salts Secondary alcohols Chlorohydrins 1,2-aminoalcohols Monocarboxylic acids and derivatives Carboxylic acids Organochlorides Organic oxides Organic chloride salts Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides Organic cations
Molecular Framework
Not available
Substituents
Choline - Tetraalkylammonium salt - 1,2-aminoalcohol - Chlorohydrin - Halohydrin - Secondary alcohol - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Alcohol - Organochloride - Organohalogen compound - Organooxygen compound - Organic salt - Organic chloride salt - Hydrocarbon derivative - Organic oxide - Carbonyl group - Amine - Alkyl halide - Alkyl chloride - Organic cation - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as cholines. These are organic compounds containing a N,N,N-trimethylethanolammonium cation.
External Descriptors
Not available