zinc 3,5-bis[(2-methylphenyl)methyl]-2-oxidanyl-benzoate

Systemtic Name: zinc 3,5-bis[(2-methylphenyl)methyl]-2-oxidanyl-benzoate Openeye Name: zinc 2-hydroxy-3,5-bis(o-tolylmethyl)benzoate CAS Name: zinc 2-hydroxy-3,5-bis[(2-methylphenyl)methyl]benzoate IUPAC Name: zinc 2-hydroxy-3,5-bis[(2-methylphenyl)methyl]benzoate Traditional Name: zinc 2-hydroxy-3,5-bis(2-methylbenzyl)benzoate Formula: C46H42O6Zn MolecularWeight: 756.23108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2=CC(=C(C(=C2)C(=O)[O-])O)CC3=CC=CC=C3C.CC1=CC=CC=C1CC2=CC(=C(C(=C2)C(=O)[O-])O)CC3=CC=CC=C3C.[Zn+2]

Isomeric SMILES

CC1=CC=CC=C1CC2=CC(=C(C(=C2)C(=O)[O-])O)CC3=CC=CC=C3C.CC1=CC=CC=C1CC2=CC(=C(C(=C2)C(=O)[O-])O)CC3=CC=CC=C3C.[Zn+2]

InChI

InChI=1S/2C23H22O3.Zn/c2*1-15-7-3-5-9-18(15)11-17-12-20(22(24)21(13-17)23(25)26)14-19-10-6-4-8-16(19)2;/h2*3-10,12-13,24H,11,14H2,1-2H3,(H,25,26);/q;;+2/p-2