disodium 2-[[8-(2-sulfonatoethoxymethyl)-1,2,5,6-tetrathiocan-3-yl]methoxy]ethanesulfonate

Systemtic Name: disodium 2-[[8-(2-sulfonatoethoxymethyl)-1,2,5,6-tetrathiocan-3-yl]methoxy]ethanesulfonate Openeye Name: disodium 2-[[8-(2-sulfonatoethoxymethyl)-1,2,5,6-tetrathiocan-3-yl]methoxy]ethanesulfonate CAS Name: disodium 2-[[8-(2-sulfonatoethoxymethyl)-1,2,5,6-tetrathiocan-3-yl]methoxy]ethanesulfonate IUPAC Name: disodium 2-[[8-(2-sulfonatoethoxymethyl)-1,2,5,6-tetrathiocan-3-yl]methoxy]ethanesulfonate Traditional Name: disodium 2-[[8-(2-sulfonatoethoxymethyl)-1,2,5,6-tetrathiocan-3-yl]methoxy]ethanesulfonate Formula: C10H18Na2O8S6 MolecularWeight: 504.61466

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SSC(CSS1)COCCS(=O)(=O)[O-])COCCS(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1C(SSC(CSS1)COCCS(=O)(=O)[O-])COCCS(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C10H20O8S6.2Na/c11-23(12,13)3-1-17-5-9-7-19-20-8-10(22-21-9)6-18-2-4-24(14,15)16;;/h9-10H,1-8H2,(H,11,12,13)(H,14,15,16);;/q;2*+1/p-2