copper; 2-oxidanyl-3,5-di(propan-2-yl)benzoic acid; hydrate

Systemtic Name: copper; 2-oxidanyl-3,5-di(propan-2-yl)benzoic acid; hydrate Openeye Name: copper; 2-hydroxy-3,5-diisopropyl-benzoic acid; hydrate CAS Name: copper; 2-hydroxy-3,5-di(propan-2-yl)benzoic acid; hydrate IUPAC Name: copper; 2-hydroxy-3,5-di(propan-2-yl)benzoic acid; hydrate Traditional Name: copper; 2-hydroxy-3,5-diisopropyl-benzoic acid; hydrate Formula: C26H38CuO7 MolecularWeight: 526.12172

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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.O.[Cu]

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.O.[Cu]

InChI

InChI=1S/2C13H18O3.Cu.H2O/c2*1-7(2)9-5-10(8(3)4)12(14)11(6-9)13(15)16;;/h2*5-8,14H,1-4H3,(H,15,16);;1H2