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

Systemtic Name: 2-tert-butyl-2-[3,5-di(propan-2-yl)phenyl]-5-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 2-tert-butyl-2-(3,5-diisopropylphenyl)-5-phenyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 2-tert-butyl-2-[3,5-di(propan-2-yl)phenyl]-5-phenyl-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 2-tert-butyl-2-[3,5-di(propan-2-yl)phenyl]-5-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 2-tert-butyl-2-(3,5-diisopropylphenyl)-5-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C31H35Cl2Zr- MolecularWeight: 569.7396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=C1)C2(C=C3C=C(C=CC3=[C-]2)C4=CC=CC=C4)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)C4=CC=CC=C4)C(C)(C)C)C(C)C.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C31H35.2ClH.Zr/c1-21(2)26-16-27(22(3)4)18-29(17-26)31(30(5,6)7)19-25-14-13-24(15-28(25)20-31)23-11-9-8-10-12-23;;;/h8-18,20-22H,1-7H3;2*1H;/q-1;;;+2/p-2