4-octadecyl-2,5-bis(oxidanyl)benzenesulfonate

Systemtic Name: 4-octadecyl-2,5-bis(oxidanyl)benzenesulfonate Openeye Name: 2,5-dihydroxy-4-octadecyl-benzenesulfonate CAS Name: 2,5-dihydroxy-4-octadecylbenzenesulfonate IUPAC Name: 2,5-dihydroxy-4-octadecylbenzenesulfonate Traditional Name: 2,5-dihydroxy-4-stearyl-besylate Formula: C24H41O5S- MolecularWeight: 441.64434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=CC(=C(C=C1O)S(=O)(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=CC(=C(C=C1O)S(=O)(=O)[O-])O

InChI

InChI=1S/C24H42O5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-19-23(26)24(20-22(21)25)30(27,28)29/h19-20,25-26H,2-18H2,1H3,(H,27,28,29)/p-1