[3-[4-(3-methylsulfonyloxypropanoyl)piperazin-1-yl]-3-oxidanylidene-propyl] methanesulfonate

Systemtic Name: [3-[4-(3-methylsulfonyloxypropanoyl)piperazin-1-yl]-3-oxidanylidene-propyl] methanesulfonate Openeye Name: [3-[4-(3-methylsulfonyloxypropanoyl)piperazin-1-yl]-3-oxo-propyl] methanesulfonate CAS Name: methanesulfonic acid [3-[4-(3-methylsulfonyloxy-1-oxopropyl)-1-piperazinyl]-3-oxopropyl] ester IUPAC Name: [3-[4-(3-methylsulfonyloxypropanoyl)piperazin-1-yl]-3-oxopropyl] methanesulfonate Traditional Name: methanesulfonic acid [3-keto-3-[4-(3-methylsulfonyloxypropanoyl)piperazino]propyl] ester Formula: C12H22N2O8S2 MolecularWeight: 386.44168

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCC(=O)N1CCN(CC1)C(=O)CCOS(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)OCCC(=O)N1CCN(CC1)C(=O)CCOS(=O)(=O)C

InChI

InChI=1S/C12H22N2O8S2/c1-23(17,18)21-9-3-11(15)13-5-7-14(8-6-13)12(16)4-10-22-24(2,19)20/h3-10H2,1-2H3