2-butan-2-yl-2-(3,5-dimethylphenyl)-5-methyl-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 2-butan-2-yl-2-(3,5-dimethylphenyl)-5-methyl-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 2-(3,5-dimethylphenyl)-5-methyl-2-sec-butyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 2-butan-2-yl-2-(3,5-dimethylphenyl)-5-methyl-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 2-butan-2-yl-2-(3,5-dimethylphenyl)-5-methyl-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 2-(3,5-dimethylphenyl)-5-methyl-2-sec-butyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C22H25Cl2Zr- MolecularWeight: 451.5639

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25.2ClH.Zr/c1-6-18(5)22(21-11-16(3)9-17(4)12-21)13-19-8-7-15(2)10-20(19)14-22;;;/h7-12,14,18H,6H2,1-5H3;2*1H;/q-1;;;+2/p-2