2-(4-tert-butylphenyl)propanethioate; nickel(2+)

Systemtic Name: 2-(4-tert-butylphenyl)propanethioate; nickel(2+) Openeye Name: nickelous 2-(4-tert-butylphenyl)propanethioate CAS Name: 2-(4-tert-butylphenyl)propanethioate; nickel(2+) IUPAC Name: 2-(4-tert-butylphenyl)propanethioate; nickel(2+) Traditional Name: nickelous 2-(4-tert-butylphenyl)thiopropionate Formula: C26H34NiO2S2 MolecularWeight: 501.37036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(C)(C)C)C(=S)[O-].CC(C1=CC=C(C=C1)C(C)(C)C)C(=S)[O-].[Ni+2]

Isomeric SMILES

CC(C1=CC=C(C=C1)C(C)(C)C)C(=S)[O-].CC(C1=CC=C(C=C1)C(C)(C)C)C(=S)[O-].[Ni+2]

InChI

InChI=1S/2C13H18OS.Ni/c2*1-9(12(14)15)10-5-7-11(8-6-10)13(2,3)4;/h2*5-9H,1-4H3,(H,14,15);/q;;+2/p-2