2,6-di(butan-2-yl)phenolate; zirconium(2+); chloride

Systemtic Name: 2,6-di(butan-2-yl)phenolate; zirconium(2+); chloride Openeye Name: 2,6-disec-butylphenolate; zirconium(2+); chloride CAS Name: 2,6-di(butan-2-yl)phenolate; zirconium(2+); chloride IUPAC Name: 2,6-di(butan-2-yl)phenolate; zirconium(2+); chloride Traditional Name: 2,6-disec-butylphenolate; zirconium(2+); chloride Formula: C14H21ClOZr MolecularWeight: 331.99294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22O.ClH.Zr/c1-5-10(3)12-8-7-9-13(14(12)15)11(4)6-2;;/h7-11,15H,5-6H2,1-4H3;1H;/q;;+2/p-2