hexadecyl-dimethyl-(2-methylsulfonyloxyethyl)azanium chloride

Systemtic Name: hexadecyl-dimethyl-(2-methylsulfonyloxyethyl)azanium chloride Openeye Name: hexadecyl-dimethyl-(2-methylsulfonyloxyethyl)ammonium chloride CAS Name: hexadecyl-dimethyl-(2-methylsulfonyloxyethyl)ammonium chloride IUPAC Name: hexadecyl-dimethyl-(2-methylsulfonyloxyethyl)azanium chloride Traditional Name: cetyl-dimethyl-(2-methylsulfonyloxyethyl)ammonium chloride Formula: C21H46ClNO3S MolecularWeight: 428.11284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCOS(=O)(=O)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCOS(=O)(=O)C.[Cl-]

InChI

InChI=1S/C21H46NO3S.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(2,3)20-21-25-26(4,23)24;/h5-21H2,1-4H3;1H/q+1;/p-1