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3-[hexadecyl(dimethyl)azaniumyl]propane-1-sulfonate

3-[hexadecyl(dimethyl)azaniumyl]propane-1-sulfonate

Systemtic Name:3-[hexadecyl(dimethyl)azaniumyl]propane-1-sulfonate
Openeye Name:3-[hexadecyl(dimethyl)ammonio]propane-1-sulfonate
CAS Name:3-[hexadecyl(dimethyl)ammonio]-1-propanesulfonate
IUPAC Name:3-[hexadecyl(dimethyl)azaniumyl]propane-1-sulfonate
Traditional Name:3-[cetyl(dimethyl)ammonio]propane-1-sulfonate
Formula: C21H45NO3S
MolecularWeight: 391.6519
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCCS(=O)(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCCS(=O)(=O)[O-]


InChI

InChI=1S/C21H45NO3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22(2,3)20-18-21-26(23,24)25/h4-21H2,1-3H3


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