4-hexadecyl-4-methyl-thiomorpholin-4-ium; methyl-tris(oxidanyl)-oxidanylidene-$l^{6}-sulfane

Systemtic Name: 4-hexadecyl-4-methyl-thiomorpholin-4-ium; methyl-tris(oxidanyl)-oxidanylidene-$l^{6}-sulfane Openeye Name: 4-hexadecyl-4-methyl-thiomorpholin-4-ium; trihydroxy-methyl-oxo-$l^{6}-sulfane CAS Name: 4-hexadecyl-4-methylthiomorpholin-4-ium; trihydroxy-methyl-oxo-$l^{6}-sulfane IUPAC Name: 4-hexadecyl-4-methylthiomorpholin-4-ium; trihydroxy-methyl-oxo-$l^{6}-sulfane Traditional Name: 4-cetyl-4-methyl-thiomorpholin-4-ium; trihydroxy-keto-methyl-$l^{6}-sulfane Formula: C22H50NO4S2+ MolecularWeight: 456.7667

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+]1(CCSCC1)C.CS(=O)(O)(O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+]1(CCSCC1)C.CS(=O)(O)(O)O

InChI

InChI=1S/C21H44NS.CH6O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(2)18-20-23-21-19-22;1-6(2,3,4)5/h3-21H2,1-2H3;1H3,(H3,2,3,4,5)/q+1;