zinc 4-methyl-2-oxidanyl-3-(1-phenylethyl)benzoate

Systemtic Name: zinc 4-methyl-2-oxidanyl-3-(1-phenylethyl)benzoate Openeye Name: zinc 2-hydroxy-4-methyl-3-(1-phenylethyl)benzoate CAS Name: zinc 2-hydroxy-4-methyl-3-(1-phenylethyl)benzoate IUPAC Name: zinc 2-hydroxy-4-methyl-3-(1-phenylethyl)benzoate Traditional Name: zinc 2-hydroxy-4-methyl-3-(1-phenylethyl)benzoate Formula: C32H30O6Zn MolecularWeight: 575.986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)[O-])O)C(C)C2=CC=CC=C2.CC1=C(C(=C(C=C1)C(=O)[O-])O)C(C)C2=CC=CC=C2.[Zn+2]

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)[O-])O)C(C)C2=CC=CC=C2.CC1=C(C(=C(C=C1)C(=O)[O-])O)C(C)C2=CC=CC=C2.[Zn+2]

InChI

InChI=1S/2C16H16O3.Zn/c2*1-10-8-9-13(16(18)19)15(17)14(10)11(2)12-6-4-3-5-7-12;/h2*3-9,11,17H,1-2H3,(H,18,19);/q;;+2/p-2