3,5-bis(2-methylbutan-2-yl)-4-oxidanyl-benzoate; manganese(2+)

Systemtic Name: 3,5-bis(2-methylbutan-2-yl)-4-oxidanyl-benzoate; manganese(2+) Openeye Name: manganous 3,5-bis(1,1-dimethylpropyl)-4-hydroxy-benzoate CAS Name: 4-hydroxy-3,5-bis(2-methylbutan-2-yl)benzoate; manganese(2+) IUPAC Name: 4-hydroxy-3,5-bis(2-methylbutan-2-yl)benzoate; manganese(2+) Traditional Name: manganous 3,5-ditert-amyl-4-hydroxy-benzoate Formula: C34H50MnO6 MolecularWeight: 609.695249

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CC)C(=O)[O-].CCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CC)C(=O)[O-].[Mn+2]

Isomeric SMILES

CCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CC)C(=O)[O-].CCC(C)(C)C1=CC(=CC(=C1O)C(C)(C)CC)C(=O)[O-].[Mn+2]

InChI

InChI=1S/2C17H26O3.Mn/c2*1-7-16(3,4)12-9-11(15(19)20)10-13(14(12)18)17(5,6)8-2;/h2*9-10,18H,7-8H2,1-6H3,(H,19,20);/q;;+2/p-2