4-tert-butylbenzoate; titanium(2+)

Systemtic Name: 4-tert-butylbenzoate; titanium(2+) Openeye Name: 4-tert-butylbenzoate; titanium(2+) CAS Name: 4-tert-butylbenzoate; titanium(2+) IUPAC Name: 4-tert-butylbenzoate; titanium(2+) Traditional Name: 4-tert-butylbenzoate; titanium(2+) Formula: C22H26O4Ti MolecularWeight: 402.30644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C11H14O2.Ti/c2*1-11(2,3)9-6-4-8(5-7-9)10(12)13;/h2*4-7H,1-3H3,(H,12,13);/q;;+2/p-2