potassium 4-(15-methylhexadecyl)-3,5-bis(oxidanyl)benzenesulfonate

Systemtic Name: potassium 4-(15-methylhexadecyl)-3,5-bis(oxidanyl)benzenesulfonate Openeye Name: potassium 3,5-dihydroxy-4-(15-methylhexadecyl)benzenesulfonate CAS Name: potassium 3,5-dihydroxy-4-(15-methylhexadecyl)benzenesulfonate IUPAC Name: potassium 3,5-dihydroxy-4-(15-methylhexadecyl)benzenesulfonate Traditional Name: potassium 3,5-dihydroxy-4-(15-methylhexadecyl)besylate Formula: C23H39KO5S MolecularWeight: 466.71606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCCCCCCC1=C(C=C(C=C1O)S(=O)(=O)[O-])O.[K+]

Isomeric SMILES

CC(C)CCCCCCCCCCCCCCC1=C(C=C(C=C1O)S(=O)(=O)[O-])O.[K+]

InChI

InChI=1S/C23H40O5S.K/c1-19(2)15-13-11-9-7-5-3-4-6-8-10-12-14-16-21-22(24)17-20(18-23(21)25)29(26,27)28;/h17-19,24-25H,3-16H2,1-2H3,(H,26,27,28);/q;+1/p-1