hexadecyl(trimethyl)azanium; sulfonatooxy sulfate

Systemtic Name: hexadecyl(trimethyl)azanium; sulfonatooxy sulfate Openeye Name: hexadecyl(trimethyl)ammonium; sulfonatooxy sulfate CAS Name: hexadecyl(trimethyl)ammonium; sulfonatooxy sulfate IUPAC Name: hexadecyl(trimethyl)azanium; sulfonatooxy sulfate Traditional Name: cetyl(trimethyl)ammonium; sulfato sulfate Formula: C38H84N2O8S2 MolecularWeight: 761.21216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)C.CCCCCCCCCCCCCCCC[N+](C)(C)C.[O-]S(=O)(=O)OOS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)C.CCCCCCCCCCCCCCCC[N+](C)(C)C.[O-]S(=O)(=O)OOS(=O)(=O)[O-]

InChI

InChI=1S/2C19H42N.H2O8S2/c2*1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;1-9(2,3)7-8-10(4,5)6/h2*5-19H2,1-4H3;(H,1,2,3)(H,4,5,6)/q2*+1;/p-2