disodium 10-oxidanyl-18-[2-(2-sulfonatooxyethoxy)ethoxy]octadecane-9-sulfonate

Systemtic Name: disodium 10-oxidanyl-18-[2-(2-sulfonatooxyethoxy)ethoxy]octadecane-9-sulfonate Openeye Name: disodium 10-hydroxy-18-[2-(2-sulfonatooxyethoxy)ethoxy]octadecane-9-sulfonate CAS Name: disodium 10-hydroxy-18-[2-(2-sulfonatooxyethoxy)ethoxy]-9-octadecanesulfonate IUPAC Name: disodium 10-hydroxy-18-[2-(2-sulfonatooxyethoxy)ethoxy]octadecane-9-sulfonate Traditional Name: disodium 10-hydroxy-18-[2-(2-sulfatoethoxy)ethoxy]octadecane-9-sulfonate Formula: C22H44Na2O10S2 MolecularWeight: 578.6883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(CCCCCCCCOCCOCCOS(=O)(=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCCCCCCCC(C(CCCCCCCCOCCOCCOS(=O)(=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C22H46O10S2.2Na/c1-2-3-4-5-9-12-15-22(33(24,25)26)21(23)14-11-8-6-7-10-13-16-30-17-18-31-19-20-32-34(27,28)29;;/h21-23H,2-20H2,1H3,(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2