potassium 4-(2-oxidanyl-3-prop-2-enoxy-propoxy)benzenesulfonate

Systemtic Name: potassium 4-(2-oxidanyl-3-prop-2-enoxy-propoxy)benzenesulfonate Openeye Name: potassium 4-(3-allyloxy-2-hydroxy-propoxy)benzenesulfonate CAS Name: potassium 4-(2-hydroxy-3-prop-2-enoxypropoxy)benzenesulfonate IUPAC Name: potassium 4-(2-hydroxy-3-prop-2-enoxypropoxy)benzenesulfonate Traditional Name: potassium 4-(3-allyloxy-2-hydroxy-propoxy)besylate Formula: C12H15KO6S MolecularWeight: 326.4072

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOCC(COC1=CC=C(C=C1)S(=O)(=O)[O-])O.[K+]

Isomeric SMILES

C=CCOCC(COC1=CC=C(C=C1)S(=O)(=O)[O-])O.[K+]

InChI

InChI=1S/C12H16O6S.K/c1-2-7-17-8-10(13)9-18-11-3-5-12(6-4-11)19(14,15)16;/h2-6,10,13H,1,7-9H2,(H,14,15,16);/q;+1/p-1