hexadecyl(dimethyl)azanium; methyl sulfate

Systemtic Name: hexadecyl(dimethyl)azanium; methyl sulfate Openeye Name: hexadecyl(dimethyl)ammonium; methyl sulfate CAS Name: hexadecyl(dimethyl)ammonium; methyl sulfate IUPAC Name: hexadecyl(dimethyl)azanium; methyl sulfate Traditional Name: cetyl(dimethyl)ammonium; methyl sulfate Formula: C19H43NO4S MolecularWeight: 381.61402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[NH+](C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[NH+](C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C18H39N.CH4O4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(2)3;1-5-6(2,3)4/h4-18H2,1-3H3;1H3,(H,2,3,4)