barium(2+); 2-oxidanylidene-2-phenyl-ethanesulfonate

Systemtic Name: barium(2+); 2-oxidanylidene-2-phenyl-ethanesulfonate Openeye Name: barium(2+); 2-oxo-2-phenyl-ethanesulfonate CAS Name: barium(2+); 2-oxo-2-phenylethanesulfonate IUPAC Name: barium(2+); 2-oxo-2-phenylethanesulfonate Traditional Name: barium(2+); 2-keto-2-phenyl-ethanesulfonate Formula: C16H14BaO8S2 MolecularWeight: 535.73456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CS(=O)(=O)[O-].C1=CC=C(C=C1)C(=O)CS(=O)(=O)[O-].[Ba+2]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CS(=O)(=O)[O-].C1=CC=C(C=C1)C(=O)CS(=O)(=O)[O-].[Ba+2]

InChI

InChI=1S/2C8H8O4S.Ba/c2*9-8(6-13(10,11)12)7-4-2-1-3-5-7;/h2*1-5H,6H2,(H,10,11,12);/q;;+2/p-2