[6-[5-(5-methylsulfonyloxypiperidin-2-yl)-3,6-bis(oxidanylidene)piperazin-2-yl]piperidin-3-yl] methanesulfonate

Systemtic Name: [6-[5-(5-methylsulfonyloxypiperidin-2-yl)-3,6-bis(oxidanylidene)piperazin-2-yl]piperidin-3-yl] methanesulfonate Openeye Name: [6-[5-(5-methylsulfonyloxy-2-piperidyl)-3,6-dioxo-piperazin-2-yl]-3-piperidyl] methanesulfonate CAS Name: methanesulfonic acid [6-[5-(5-methylsulfonyloxy-2-piperidinyl)-3,6-dioxo-2-piperazinyl]-3-piperidinyl] ester IUPAC Name: [6-[5-(5-methylsulfonyloxypiperidin-2-yl)-3,6-dioxopiperazin-2-yl]piperidin-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [6-[3,6-diketo-5-(5-methylsulfonyloxy-2-piperidyl)piperazin-2-yl]-3-piperidyl] ester Formula: C16H28N4O8S2 MolecularWeight: 468.54552

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CCC(NC1)C2C(=O)NC(C(=O)N2)C3CCC(CN3)OS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)OC1CCC(NC1)C2C(=O)NC(C(=O)N2)C3CCC(CN3)OS(=O)(=O)C

InChI

InChI=1S/C16H28N4O8S2/c1-29(23,24)27-9-3-5-11(17-7-9)13-15(21)20-14(16(22)19-13)12-6-4-10(8-18-12)28-30(2,25)26/h9-14,17-18H,3-8H2,1-2H3,(H,19,22)(H,20,21)