zinc 3-(10-methylundecyl)-2-oxidanyl-5-propan-2-yl-benzoate

Systemtic Name: zinc 3-(10-methylundecyl)-2-oxidanyl-5-propan-2-yl-benzoate Openeye Name: zinc 2-hydroxy-5-isopropyl-3-(10-methylundecyl)benzoate CAS Name: zinc 2-hydroxy-3-(10-methylundecyl)-5-propan-2-ylbenzoate IUPAC Name: zinc 2-hydroxy-3-(10-methylundecyl)-5-propan-2-ylbenzoate Traditional Name: zinc 2-hydroxy-5-isopropyl-3-(10-methylundecyl)benzoate Formula: C44H70O6Zn MolecularWeight: 760.432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCCC1=C(C(=CC(=C1)C(C)C)C(=O)[O-])O.CC(C)CCCCCCCCCC1=C(C(=CC(=C1)C(C)C)C(=O)[O-])O.[Zn+2]

Isomeric SMILES

CC(C)CCCCCCCCCC1=C(C(=CC(=C1)C(C)C)C(=O)[O-])O.CC(C)CCCCCCCCCC1=C(C(=CC(=C1)C(C)C)C(=O)[O-])O.[Zn+2]

InChI

InChI=1S/2C22H36O3.Zn/c2*1-16(2)12-10-8-6-5-7-9-11-13-18-14-19(17(3)4)15-20(21(18)23)22(24)25;/h2*14-17,23H,5-13H2,1-4H3,(H,24,25);/q;;+2/p-2