2,4-ditert-butylphenolate; zirconium(2+); chloride

Systemtic Name: 2,4-ditert-butylphenolate; zirconium(2+); chloride Openeye Name: 2,4-ditert-butylphenolate; zirconium(2+); chloride CAS Name: 2,4-ditert-butylphenolate; zirconium(2+); chloride IUPAC Name: 2,4-ditert-butylphenolate; zirconium(2+); chloride Traditional Name: 2,4-ditert-butylphenolate; zirconium(2+); chloride Formula: C14H21ClOZr MolecularWeight: 331.99294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22O.ClH.Zr/c1-13(2,3)10-7-8-12(15)11(9-10)14(4,5)6;;/h7-9,15H,1-6H3;1H;/q;;+2/p-2