disodium 2-oxidanyl-3-[4-(2-oxidanyl-3-sulfonato-propoxy)but-2-ynoxy]propane-1-sulfonate

Systemtic Name: disodium 2-oxidanyl-3-[4-(2-oxidanyl-3-sulfonato-propoxy)but-2-ynoxy]propane-1-sulfonate Openeye Name: disodium 2-hydroxy-3-[4-(2-hydroxy-3-sulfonato-propoxy)but-2-ynoxy]propane-1-sulfonate CAS Name: disodium 2-hydroxy-3-[4-(2-hydroxy-3-sulfonatopropoxy)but-2-ynoxy]-1-propanesulfonate IUPAC Name: disodium 2-hydroxy-3-[4-(2-hydroxy-3-sulfonatopropoxy)but-2-ynoxy]propane-1-sulfonate Traditional Name: disodium 2-hydroxy-3-[4-(2-hydroxy-3-sulfonato-propoxy)but-2-ynoxy]propane-1-sulfonate Formula: C10H16Na2O10S2 MolecularWeight: 406.33758

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Descriptors Computed from Structure

Canonical SMILES:

C(C#CCOCC(CS(=O)(=O)[O-])O)OCC(CS(=O)(=O)[O-])O.[Na+].[Na+]

Isomeric SMILES

C(C#CCOCC(CS(=O)(=O)[O-])O)OCC(CS(=O)(=O)[O-])O.[Na+].[Na+]

InChI

InChI=1S/C10H18O10S2.2Na/c11-9(7-21(13,14)15)5-19-3-1-2-4-20-6-10(12)8-22(16,17)18;;/h9-12H,3-8H2,(H,13,14,15)(H,16,17,18);;/q;2*+1/p-2