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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1(C=C2C=C(C=CC2=[C-]1)C3=CC=CC=C3)C4=CC(=CC(=C4)C(C)C)C(C)C.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CCC(C)C1(C=C2C=C(C=CC2=[C-]1)C3=CC=CC=C3)C4=CC(=CC(=C4)C(C)C)C(C)C.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C31H35.2ClH.Zr/c1-7-23(6)31(30-17-27(21(2)3)16-28(18-30)22(4)5)19-26-14-13-25(15-29(26)20-31)24-11-9-8-10-12-24;;;/h8-18,20-23H,7H2,1-6H3;2*1H;/q-1;;;+2/p-2