methyl hydrogen sulfate; 4-methyl-4-tetradecyl-1,4-thiazinan-4-ium 1-oxide

Systemtic Name: methyl hydrogen sulfate; 4-methyl-4-tetradecyl-1,4-thiazinan-4-ium 1-oxide Openeye Name: methyl hydrogen sulfate; 4-methyl-4-tetradecyl-1,4-thiazinan-4-ium 1-oxide CAS Name: 4-methyl-4-tetradecyl-1,4-thiazinan-4-ium 1-oxide; sulfuric acid methyl ester IUPAC Name: methyl hydrogen sulfate; 4-methyl-4-tetradecyl-1,4-thiazinan-4-ium 1-oxide Traditional Name: 4-methyl-4-myristyl-1,4-thiazinan-4-ium 1-oxide; sulfuric acid methyl ester Formula: C20H44NO5S2+ MolecularWeight: 442.69706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC[N+]1(CCS(=O)CC1)C.COS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCC[N+]1(CCS(=O)CC1)C.COS(=O)(=O)O

InChI

InChI=1S/C19H40NOS.CH4O4S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20(2)16-18-22(21)19-17-20;1-5-6(2,3)4/h3-19H2,1-2H3;1H3,(H,2,3,4)/q+1;