2,6-ditert-butyl-4-methyl-phenolate; zirconium(2+); chloride

Systemtic Name: 2,6-ditert-butyl-4-methyl-phenolate; zirconium(2+); chloride Openeye Name: 2,6-ditert-butyl-4-methyl-phenolate; zirconium(2+); chloride CAS Name: 2,6-ditert-butyl-4-methylphenolate; zirconium(2+); chloride IUPAC Name: 2,6-ditert-butyl-4-methylphenolate; zirconium(2+); chloride Traditional Name: 2,6-ditert-butyl-4-methyl-phenolate; zirconium(2+); chloride Formula: C15H23ClOZr MolecularWeight: 346.01952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(C)(C)C)[O-])C(C)(C)C.[Cl-].[Zr+2]

Isomeric SMILES

CC1=CC(=C(C(=C1)C(C)(C)C)[O-])C(C)(C)C.[Cl-].[Zr+2]

InChI

InChI=1S/C15H24O.ClH.Zr/c1-10-8-11(14(2,3)4)13(16)12(9-10)15(5,6)7;;/h8-9,16H,1-7H3;1H;/q;;+2/p-2