3-[4-(3-sulfonatopropoxy)phenoxy]propane-1-sulfonate

Systemtic Name: 3-[4-(3-sulfonatopropoxy)phenoxy]propane-1-sulfonate Openeye Name: 3-[4-(3-sulfonatopropoxy)phenoxy]propane-1-sulfonate CAS Name: 3-[4-(3-sulfonatopropoxy)phenoxy]-1-propanesulfonate IUPAC Name: 3-[4-(3-sulfonatopropoxy)phenoxy]propane-1-sulfonate Traditional Name: 3-[4-(3-sulfonatopropoxy)phenoxy]propane-1-sulfonate Formula: C12H16O8S2-2 MolecularWeight: 352.38064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCCS(=O)(=O)[O-])OCCCS(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1OCCCS(=O)(=O)[O-])OCCCS(=O)(=O)[O-]

InChI

InChI=1S/C12H18O8S2/c13-21(14,15)9-1-7-19-11-3-5-12(6-4-11)20-8-2-10-22(16,17)18/h3-6H,1-2,7-10H2,(H,13,14,15)(H,16,17,18)/p-2