sodium 2-[1-cyclohexyl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylethanesulfonate

Systemtic Name: sodium 2-[1-cyclohexyl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanylethanesulfonate Openeye Name: sodium 2-(1-cyclohexyl-2,5-dioxo-pyrrolidin-3-yl)sulfanylethanesulfonate CAS Name: sodium 2-[(1-cyclohexyl-2,5-dioxo-3-pyrrolidinyl)thio]ethanesulfonate IUPAC Name: sodium 2-(1-cyclohexyl-2,5-dioxopyrrolidin-3-yl)sulfanylethanesulfonate Traditional Name: sodium 2-[(1-cyclohexyl-2,5-diketo-pyrrolidin-3-yl)thio]ethanesulfonate Formula: C12H18NNaO5S2 MolecularWeight: 343.39479

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)CC(C2=O)SCCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1CCC(CC1)N2C(=O)CC(C2=O)SCCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C12H19NO5S2.Na/c14-11-8-10(19-6-7-20(16,17)18)12(15)13(11)9-4-2-1-3-5-9;/h9-10H,1-8H2,(H,16,17,18);/q;+1/p-1