2-butan-2-yl-2-(2-phenylphenyl)-5-propan-2-yl-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 2-butan-2-yl-2-(2-phenylphenyl)-5-propan-2-yl-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 5-isopropyl-2-(2-phenylphenyl)-2-sec-butyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 2-butan-2-yl-2-(2-phenylphenyl)-5-propan-2-yl-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 2-butan-2-yl-2-(2-phenylphenyl)-5-propan-2-yl-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 5-isopropyl-2-(2-phenylphenyl)-2-sec-butyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C28H29Cl2Zr- MolecularWeight: 527.65986

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1(C=C2C=C(C=CC2=[C-]1)C(C)C)C3=CC=CC=C3C4=CC=CC=C4.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CCC(C)C1(C=C2C=C(C=CC2=[C-]1)C(C)C)C3=CC=CC=C3C4=CC=CC=C4.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C28H29.2ClH.Zr/c1-5-21(4)28(18-24-16-15-23(20(2)3)17-25(24)19-28)27-14-10-9-13-26(27)22-11-7-6-8-12-22;;;/h6-17,19-21H,5H2,1-4H3;2*1H;/q-1;;;+2/p-2