2-[2-(2-azaniumylethylsulfanyl)-1,3-diethoxy-1,3-bis(oxidanylidene)propan-2-yl]sulfanylethylazanium dichloride

Systemtic Name: 2-[2-(2-azaniumylethylsulfanyl)-1,3-diethoxy-1,3-bis(oxidanylidene)propan-2-yl]sulfanylethylazanium dichloride Openeye Name: 2-[1-(2-azaniumylethylsulfanyl)-2-ethoxy-1-ethoxycarbonyl-2-oxo-ethyl]sulfanylethylammonium dichloride CAS Name: 2-[[2-(2-ammonioethylthio)-1,3-diethoxy-1,3-dioxopropan-2-yl]thio]ethylammonium dichloride IUPAC Name: 2-[2-(2-azaniumylethylsulfanyl)-1,3-diethoxy-1,3-dioxopropan-2-yl]sulfanylethylazanium dichloride Traditional Name: 2-[[1-(2-ammonioethylthio)-1-carbethoxy-2-ethoxy-2-keto-ethyl]thio]ethylammonium dichloride Formula: C11H24Cl2N2O4S2 MolecularWeight: 383.35526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)(SCC[NH3+])SCC[NH3+].[Cl-].[Cl-]

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)(SCC[NH3+])SCC[NH3+].[Cl-].[Cl-]

InChI

InChI=1S/C11H22N2O4S2.2ClH/c1-3-16-9(14)11(18-7-5-12,19-8-6-13)10(15)17-4-2;;/h3-8,12-13H2,1-2H3;2*1H