zinc 2,5-dimethyl-6-oxidanyl-3-(2-phenylpropan-2-yl)benzoate

Systemtic Name: zinc 2,5-dimethyl-6-oxidanyl-3-(2-phenylpropan-2-yl)benzoate Openeye Name: zinc 2-hydroxy-3,6-dimethyl-5-(1-methyl-1-phenyl-ethyl)benzoate CAS Name: zinc 2-hydroxy-3,6-dimethyl-5-(2-phenylpropan-2-yl)benzoate IUPAC Name: zinc 2-hydroxy-3,6-dimethyl-5-(2-phenylpropan-2-yl)benzoate Traditional Name: zinc 5-cumyl-2-hydroxy-3,6-dimethyl-benzoate Formula: C18H19O3Zn+ MolecularWeight: 348.75066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20O3.Zn/c1-11-10-14(12(2)15(16(11)19)17(20)21)18(3,4)13-8-6-5-7-9-13;/h5-10,19H,1-4H3,(H,20,21);/q;+2/p-1