2-(3,5-ditert-butylphenyl)-5-methyl-2-(2-methylpropyl)-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 2-(3,5-ditert-butylphenyl)-5-methyl-2-(2-methylpropyl)-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 2-(3,5-ditert-butylphenyl)-2-isobutyl-5-methyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 2-(3,5-ditert-butylphenyl)-5-methyl-2-(2-methylpropyl)-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 2-(3,5-ditert-butylphenyl)-5-methyl-2-(2-methylpropyl)-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 2-(3,5-ditert-butylphenyl)-2-isobutyl-5-methyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C28H37Cl2Zr- MolecularWeight: 535.72338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC([C-]=C2C=C1)(CC(C)C)C3=CC(=CC(=C3)C(C)(C)C)C(C)(C)C.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CC1=CC2=CC([C-]=C2C=C1)(CC(C)C)C3=CC(=CC(=C3)C(C)(C)C)C(C)(C)C.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C28H37.2ClH.Zr/c1-19(2)16-28(17-21-11-10-20(3)12-22(21)18-28)25-14-23(26(4,5)6)13-24(15-25)27(7,8)9;;;/h10-15,18-19H,16H2,1-9H3;2*1H;/q-1;;;+2/p-2