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2-hexadecylnonadecylazanium; methyl sulfate

2-hexadecylnonadecylazanium; methyl sulfate

Systemtic Name:2-hexadecylnonadecylazanium; methyl sulfate
Openeye Name:2-hexadecylnonadecylammonium; methyl sulfate
CAS Name:2-hexadecylnonadecylammonium; methyl sulfate
IUPAC Name:2-hexadecylnonadecylazanium; methyl sulfate
Traditional Name:2-cetylnonadecylammonium; methyl sulfate
Formula: C36H77NO4S
MolecularWeight: 620.06588
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)C[NH3+].COS(=O)(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)C[NH3+].COS(=O)(=O)[O-]


InChI

InChI=1S/C35H73N.CH4O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35(34-36)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-5-6(2,3)4/h35H,3-34,36H2,1-2H3;1H3,(H,2,3,4)


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