5-tert-butyl-2-(3,5-dimethylphenyl)-2-ethyl-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 5-tert-butyl-2-(3,5-dimethylphenyl)-2-ethyl-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 5-tert-butyl-2-(3,5-dimethylphenyl)-2-ethyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 5-tert-butyl-2-(3,5-dimethylphenyl)-2-ethyl-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 5-tert-butyl-2-(3,5-dimethylphenyl)-2-ethyl-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 5-tert-butyl-2-(3,5-dimethylphenyl)-2-ethyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C23H27Cl2Zr- MolecularWeight: 465.59048

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C=C2C=C(C=CC2=[C-]1)C(C)(C)C)C3=CC(=CC(=C3)C)C.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CCC1(C=C2C=C(C=CC2=[C-]1)C(C)(C)C)C3=CC(=CC(=C3)C)C.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C23H27.2ClH.Zr/c1-7-23(21-11-16(2)10-17(3)12-21)14-18-8-9-20(22(4,5)6)13-19(18)15-23;;;/h8-13,15H,7H2,1-6H3;2*1H;/q-1;;;+2/p-2