2-oxidanyl-3-prop-2-enoxy-propane-1-sulfonic acid sulfate

Systemtic Name: 2-oxidanyl-3-prop-2-enoxy-propane-1-sulfonic acid sulfate Openeye Name: 3-allyloxy-2-hydroxy-propane-1-sulfonic acid sulfate CAS Name: 2-hydroxy-3-prop-2-enoxy-1-propanesulfonic acid sulfate IUPAC Name: 2-hydroxy-3-prop-2-enoxypropane-1-sulfonic acid sulfate Traditional Name: 3-allyloxy-2-hydroxy-propane-1-sulfonic acid sulfate Formula: C6H12O9S2-2 MolecularWeight: 292.28408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOCC(CS(=O)(=O)O)O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C=CCOCC(CS(=O)(=O)O)O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C6H12O5S.H2O4S/c1-2-3-11-4-6(7)5-12(8,9)10;1-5(2,3)4/h2,6-7H,1,3-5H2,(H,8,9,10);(H2,1,2,3,4)/p-2