dicopper 2-oxidanyl-3,5-di(propan-2-yl)benzoate

Systemtic Name: dicopper 2-oxidanyl-3,5-di(propan-2-yl)benzoate Openeye Name: dicopper 2-hydroxy-3,5-diisopropyl-benzoate CAS Name: dicopper 2-hydroxy-3,5-di(propan-2-yl)benzoate IUPAC Name: dicopper 2-hydroxy-3,5-di(propan-2-yl)benzoate Traditional Name: dicupric 2-hydroxy-3,5-diisopropyl-benzoate Formula: C52H68Cu2O12 MolecularWeight: 1012.18112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/4C13H18O3.2Cu/c4*1-7(2)9-5-10(8(3)4)12(14)11(6-9)13(15)16;;/h4*5-8,14H,1-4H3,(H,15,16);;/q;;;;2*+2/p-4