zinc 5-tert-butyl-3-(7-methyloctyl)-2-oxidanyl-benzoate

Systemtic Name: zinc 5-tert-butyl-3-(7-methyloctyl)-2-oxidanyl-benzoate Openeye Name: zinc 5-tert-butyl-2-hydroxy-3-(7-methyloctyl)benzoate CAS Name: zinc 5-tert-butyl-2-hydroxy-3-(7-methyloctyl)benzoate IUPAC Name: zinc 5-tert-butyl-2-hydroxy-3-(7-methyloctyl)benzoate Traditional Name: zinc 5-tert-butyl-2-hydroxy-3-(7-methyloctyl)benzoate Formula: C40H62O6Zn MolecularWeight: 704.32568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCC1=C(C(=CC(=C1)C(C)(C)C)C(=O)[O-])O.CC(C)CCCCCCC1=C(C(=CC(=C1)C(C)(C)C)C(=O)[O-])O.[Zn+2]

Isomeric SMILES

CC(C)CCCCCCC1=C(C(=CC(=C1)C(C)(C)C)C(=O)[O-])O.CC(C)CCCCCCC1=C(C(=CC(=C1)C(C)(C)C)C(=O)[O-])O.[Zn+2]

InChI

InChI=1S/2C20H32O3.Zn/c2*1-14(2)10-8-6-7-9-11-15-12-16(20(3,4)5)13-17(18(15)21)19(22)23;/h2*12-14,21H,6-11H2,1-5H3,(H,22,23);/q;;+2/p-2