(4-oxidanyl-2-phenyl-butyl)sulfanium sulfate

Systemtic Name: (4-oxidanyl-2-phenyl-butyl)sulfanium sulfate Openeye Name: (4-hydroxy-2-phenyl-butyl)sulfonium sulfate CAS Name: (4-hydroxy-2-phenylbutyl)sulfonium sulfate IUPAC Name: (4-hydroxy-2-phenylbutyl)sulfanium sulfate Traditional Name: (4-hydroxy-2-phenyl-butyl)sulfonium sulfate Formula: C10H15O5S2- MolecularWeight: 279.3531

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCO)C[SH2+].[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(CCO)C[SH2+].[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C10H14OS.H2O4S/c11-7-6-10(8-12)9-4-2-1-3-5-9;1-5(2,3)4/h1-5,10-12H,6-8H2;(H2,1,2,3,4)/p-1