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4-hexadecylmorpholin-4-ium; methyl sulfate

4-hexadecylmorpholin-4-ium; methyl sulfate

Systemtic Name:4-hexadecylmorpholin-4-ium; methyl sulfate
Openeye Name:4-hexadecylmorpholin-4-ium; methyl sulfate
CAS Name:4-hexadecylmorpholin-4-ium; methyl sulfate
IUPAC Name:4-hexadecylmorpholin-4-ium; methyl sulfate
Traditional Name:4-cetylmorpholin-4-ium; methyl sulfate
Formula: C21H45NO5S
MolecularWeight: 423.6507
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[NH+]1CCOCC1.COS(=O)(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCC[NH+]1CCOCC1.COS(=O)(=O)[O-]


InChI

InChI=1S/C20H41NO.CH4O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-17-19-22-20-18-21;1-5-6(2,3)4/h2-20H2,1H3;1H3,(H,2,3,4)


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