9-(5,5-dimethyl-1-sulfamoyl-octoxy)-5,5-dimethyl-nonane-1-sulfonic acid

Systemtic Name: 9-(5,5-dimethyl-1-sulfamoyl-octoxy)-5,5-dimethyl-nonane-1-sulfonic acid Openeye Name: 9-(5,5-dimethyl-1-sulfamoyl-octoxy)-5,5-dimethyl-nonane-1-sulfonic acid CAS Name: 9-(5,5-dimethyl-1-sulfamoyloctoxy)-5,5-dimethyl-1-nonanesulfonic acid IUPAC Name: 9-(5,5-dimethyl-1-sulfamoyloctoxy)-5,5-dimethylnonane-1-sulfonic acid Traditional Name: 9-(5,5-dimethyl-1-sulfamoyl-octoxy)-5,5-dimethyl-nonane-1-sulfonic acid Formula: C21H45NO6S2 MolecularWeight: 471.7151

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)CCCC(OCCCCC(C)(C)CCCCS(=O)(=O)O)S(=O)(=O)N

Isomeric SMILES

CCCC(C)(C)CCCC(OCCCCC(C)(C)CCCCS(=O)(=O)O)S(=O)(=O)N

InChI

InChI=1S/C21H45NO6S2/c1-6-13-20(2,3)16-11-12-19(30(22,26)27)28-17-9-7-14-21(4,5)15-8-10-18-29(23,24)25/h19H,6-18H2,1-5H3,(H2,22,26,27)(H,23,24,25)