zinc 3,5-ditert-butyl-2-oxidanyl-benzoate dihydrate

Systemtic Name: zinc 3,5-ditert-butyl-2-oxidanyl-benzoate dihydrate Openeye Name: zinc 3,5-ditert-butyl-2-hydroxy-benzoate dihydrate CAS Name: zinc 3,5-ditert-butyl-2-hydroxybenzoate dihydrate IUPAC Name: zinc 3,5-ditert-butyl-2-hydroxybenzoate dihydrate Traditional Name: zinc 3,5-ditert-butyl-2-hydroxy-benzoate dihydrate Formula: C30H46O8Zn MolecularWeight: 600.09044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C15H22O3.2H2O.Zn/c2*1-14(2,3)9-7-10(13(17)18)12(16)11(8-9)15(4,5)6;;;/h2*7-8,16H,1-6H3,(H,17,18);2*1H2;/q;;;;+2/p-2