4-(1-methylpiperidin-1-ium-1-yl)-1,1-bis(oxidanylidene)thiolan-3-ol; methyl sulfate

Systemtic Name: 4-(1-methylpiperidin-1-ium-1-yl)-1,1-bis(oxidanylidene)thiolan-3-ol; methyl sulfate Openeye Name: 4-(1-methylpiperidin-1-ium-1-yl)-1,1-dioxo-thiolan-3-ol; methyl sulfate CAS Name: 4-(1-methyl-1-piperidin-1-iumyl)-1,1-dioxo-3-thiolanol; methyl sulfate IUPAC Name: 4-(1-methylpiperidin-1-ium-1-yl)-1,1-dioxothiolan-3-ol; methyl sulfate Traditional Name: 1,1-diketo-4-(1-methylpiperidin-1-ium-1-yl)thiolan-3-ol; methyl sulfate Formula: C11H23NO7S2 MolecularWeight: 345.43282

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)C2CS(=O)(=O)CC2O.COS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1(CCCCC1)C2CS(=O)(=O)CC2O.COS(=O)(=O)[O-]

InChI

InChI=1S/C10H20NO3S.CH4O4S/c1-11(5-3-2-4-6-11)9-7-15(13,14)8-10(9)12;1-5-6(2,3)4/h9-10,12H,2-8H2,1H3;1H3,(H,2,3,4)/q+1;/p-1