5-tert-butyl-2-[3,5-di(propan-2-yl)phenyl]-2-methyl-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 5-tert-butyl-2-[3,5-di(propan-2-yl)phenyl]-2-methyl-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 5-tert-butyl-2-(3,5-diisopropylphenyl)-2-methyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 5-tert-butyl-2-[3,5-di(propan-2-yl)phenyl]-2-methyl-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 5-tert-butyl-2-[3,5-di(propan-2-yl)phenyl]-2-methyl-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 5-tert-butyl-2-(3,5-diisopropylphenyl)-2-methyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C26H33Cl2Zr- MolecularWeight: 507.67022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=C1)C2(C=C3C=C(C=CC3=[C-]2)C(C)(C)C)C)C(C)C.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CC(C)C1=CC(=CC(=C1)C2(C=C3C=C(C=CC3=[C-]2)C(C)(C)C)C)C(C)C.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C26H33.2ClH.Zr/c1-17(2)20-11-21(18(3)4)13-24(12-20)26(8)15-19-9-10-23(25(5,6)7)14-22(19)16-26;;;/h9-14,16-18H,1-8H3;2*1H;/q-1;;;+2/p-2