4-ethyl-4-hexadecyl-morpholin-4-ium; methanesulfonate

Systemtic Name: 4-ethyl-4-hexadecyl-morpholin-4-ium; methanesulfonate Openeye Name: 4-ethyl-4-hexadecyl-morpholin-4-ium; methanesulfonate CAS Name: 4-ethyl-4-hexadecylmorpholin-4-ium; methanesulfonate IUPAC Name: 4-ethyl-4-hexadecylmorpholin-4-ium; methanesulfonate Traditional Name: 4-cetyl-4-ethyl-morpholin-4-ium mesylate Formula: C23H49NO4S MolecularWeight: 435.70446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+]1(CCOCC1)CC.CS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+]1(CCOCC1)CC.CS(=O)(=O)[O-]

InChI

InChI=1S/C22H46NO.CH4O3S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(4-2)19-21-24-22-20-23;1-5(2,3)4/h3-22H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1