2-(2-phenylpropan-2-yl)benzoate; titanium(2+)

Systemtic Name: 2-(2-phenylpropan-2-yl)benzoate; titanium(2+) Openeye Name: 2-(1-methyl-1-phenyl-ethyl)benzoate; titanium(2+) CAS Name: 2-(2-phenylpropan-2-yl)benzoate; titanium(2+) IUPAC Name: 2-(2-phenylpropan-2-yl)benzoate; titanium(2+) Traditional Name: 2-cumylbenzoate; titanium(2+) Formula: C32H30O4Ti MolecularWeight: 526.4452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC=CC=C2C(=O)[O-].CC(C)(C1=CC=CC=C1)C2=CC=CC=C2C(=O)[O-].[Ti+2]

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC=CC=C2C(=O)[O-].CC(C)(C1=CC=CC=C1)C2=CC=CC=C2C(=O)[O-].[Ti+2]

InChI

InChI=1S/2C16H16O2.Ti/c2*1-16(2,12-8-4-3-5-9-12)14-11-7-6-10-13(14)15(17)18;/h2*3-11H,1-2H3,(H,17,18);/q;;+2/p-2