5-methyl-2-propan-2-yl-phenolate; zirconium(2+); chloride

Systemtic Name: 5-methyl-2-propan-2-yl-phenolate; zirconium(2+); chloride Openeye Name: 2-isopropyl-5-methyl-phenolate; zirconium(2+); chloride CAS Name: 5-methyl-2-propan-2-ylphenolate; zirconium(2+); chloride IUPAC Name: 5-methyl-2-propan-2-ylphenolate; zirconium(2+); chloride Traditional Name: 2-isopropyl-5-methyl-phenolate; zirconium(2+); chloride Formula: C10H13ClOZr MolecularWeight: 275.88662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14O.ClH.Zr/c1-7(2)9-5-4-8(3)6-10(9)11;;/h4-7,11H,1-3H3;1H;/q;;+2/p-2