sodium 3-(6-methylheptoxy)-2-oxidanyl-propane-1-sulfonate

Systemtic Name: sodium 3-(6-methylheptoxy)-2-oxidanyl-propane-1-sulfonate Openeye Name: sodium 2-hydroxy-3-(6-methylheptoxy)propane-1-sulfonate CAS Name: sodium 2-hydroxy-3-(6-methylheptoxy)-1-propanesulfonate IUPAC Name: sodium 2-hydroxy-3-(6-methylheptoxy)propane-1-sulfonate Traditional Name: sodium 2-hydroxy-3-(6-methylheptoxy)propane-1-sulfonate Formula: C11H23NaO5S MolecularWeight: 290.35209

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCOCC(CS(=O)(=O)[O-])O.[Na+]

Isomeric SMILES

CC(C)CCCCCOCC(CS(=O)(=O)[O-])O.[Na+]

InChI

InChI=1S/C11H24O5S.Na/c1-10(2)6-4-3-5-7-16-8-11(12)9-17(13,14)15;/h10-12H,3-9H2,1-2H3,(H,13,14,15);/q;+1/p-1