potassium 2,3,4,5,6-pentakis-decylbenzenesulfonate

Systemtic Name: potassium 2,3,4,5,6-pentakis-decylbenzenesulfonate Openeye Name: potassium 2,3,4,5,6-pentakis-decylbenzenesulfonate CAS Name: potassium 2,3,4,5,6-pentakis-decylbenzenesulfonate IUPAC Name: potassium 2,3,4,5,6-pentakis-decylbenzenesulfonate Traditional Name: potassium 2,3,4,5,6-pentakis-decylbesylate Formula: C56H105KO3S MolecularWeight: 897.5944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=C(C(=C(C(=C1CCCCCCCCCC)CCCCCCCCCC)S(=O)(=O)[O-])CCCCCCCCCC)CCCCCCCCCC.[K+]

Isomeric SMILES

CCCCCCCCCCC1=C(C(=C(C(=C1CCCCCCCCCC)CCCCCCCCCC)S(=O)(=O)[O-])CCCCCCCCCC)CCCCCCCCCC.[K+]

InChI

InChI=1S/C56H106O3S.K/c1-6-11-16-21-26-31-36-41-46-51-52(47-42-37-32-27-22-17-12-7-2)54(49-44-39-34-29-24-19-14-9-4)56(60(57,58)59)55(50-45-40-35-30-25-20-15-10-5)53(51)48-43-38-33-28-23-18-13-8-3;/h6-50H2,1-5H3,(H,57,58,59);/q;+1/p-1