5-tert-butyl-2-(2-methylpropyl)-2-(2-propan-2-ylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 5-tert-butyl-2-(2-methylpropyl)-2-(2-propan-2-ylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 5-tert-butyl-2-isobutyl-2-(2-isopropylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 5-tert-butyl-2-(2-methylpropyl)-2-(2-propan-2-ylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 5-tert-butyl-2-(2-methylpropyl)-2-(2-propan-2-ylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 5-tert-butyl-2-isobutyl-2-o-cumenyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C26H33Cl2Zr- MolecularWeight: 507.67022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(C=C2C=C(C=CC2=[C-]1)C(C)(C)C)C3=CC=CC=C3C(C)C.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CC(C)CC1(C=C2C=C(C=CC2=[C-]1)C(C)(C)C)C3=CC=CC=C3C(C)C.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C26H33.2ClH.Zr/c1-18(2)15-26(24-11-9-8-10-23(24)19(3)4)16-20-12-13-22(25(5,6)7)14-21(20)17-26;;;/h8-14,17-19H,15H2,1-7H3;2*1H;/q-1;;;+2/p-2