sodium 2-oxidanyl-3-(3-oxidanylprop-1-ynoxy)propane-1-sulfonate

Systemtic Name: sodium 2-oxidanyl-3-(3-oxidanylprop-1-ynoxy)propane-1-sulfonate Openeye Name: sodium 2-hydroxy-3-(3-hydroxyprop-1-ynoxy)propane-1-sulfonate CAS Name: sodium 2-hydroxy-3-(3-hydroxyprop-1-ynoxy)-1-propanesulfonate IUPAC Name: sodium 2-hydroxy-3-(3-hydroxyprop-1-ynoxy)propane-1-sulfonate Traditional Name: sodium 2-hydroxy-3-(3-hydroxyprop-1-ynoxy)propane-1-sulfonate Formula: C6H9NaO6S MolecularWeight: 232.18683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H10O6S.Na/c7-2-1-3-12-4-6(8)5-13(9,10)11;/h6-8H,2,4-5H2,(H,9,10,11);/q;+1/p-1