barium(2+); 3-methylbutylsulfanyl sulfate

Systemtic Name: barium(2+); 3-methylbutylsulfanyl sulfate Openeye Name: barium(2+); isopentylsulfanyl sulfate CAS Name: barium(2+); (3-methylbutylthio) sulfate IUPAC Name: barium(2+); 3-methylbutylsulfanyl sulfate Traditional Name: barium(2+); (isoamylthio) sulfate Formula: C5H11BaO4S2+ MolecularWeight: 336.59544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSOS(=O)(=O)[O-].[Ba+2]

Isomeric SMILES

CC(C)CCSOS(=O)(=O)[O-].[Ba+2]

InChI

InChI=1S/C5H12O4S2.Ba/c1-5(2)3-4-10-9-11(6,7)8;/h5H,3-4H2,1-2H3,(H,6,7,8);/q;+2/p-1