ethanenitrile; 4-methylbenzenesulfonate; palladium(2+)

Systemtic Name: ethanenitrile; 4-methylbenzenesulfonate; palladium(2+) Openeye Name: acetonitrile; 4-methylbenzenesulfonate; palladium(2+) CAS Name: acetonitrile; 4-methylbenzenesulfonate; palladium(2+) IUPAC Name: acetonitrile; 4-methylbenzenesulfonate; palladium(2+) Traditional Name: acetonitrile; palladium(2+); tosylate Formula: C9H10NO3PdS+ MolecularWeight: 318.6656

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Descriptors Computed from Structure

Canonical SMILES:

CC#N.CC1=CC=C(C=C1)S(=O)(=O)[O-].[Pd+2]

Isomeric SMILES

CC#N.CC1=CC=C(C=C1)S(=O)(=O)[O-].[Pd+2]

InChI

InChI=1S/C7H8O3S.C2H3N.Pd/c1-6-2-4-7(5-3-6)11(8,9)10;1-2-3;/h2-5H,1H3,(H,8,9,10);1H3;/q;;+2/p-1