4-[hexadecyl(dimethyl)azaniumyl]butane-1-sulfonate

Systemtic Name: 4-[hexadecyl(dimethyl)azaniumyl]butane-1-sulfonate Openeye Name: 4-[hexadecyl(dimethyl)ammonio]butane-1-sulfonate CAS Name: 4-[hexadecyl(dimethyl)ammonio]-1-butanesulfonate IUPAC Name: 4-[hexadecyl(dimethyl)azaniumyl]butane-1-sulfonate Traditional Name: 4-[cetyl(dimethyl)ammonio]butane-1-sulfonate Formula: C22H47NO3S MolecularWeight: 405.67848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H47NO3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23(2,3)21-18-19-22-27(24,25)26/h4-22H2,1-3H3