2-tert-butyl-5-methyl-2-(2-methylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 2-tert-butyl-5-methyl-2-(2-methylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 2-tert-butyl-5-methyl-2-(o-tolyl)-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 2-tert-butyl-5-methyl-2-(2-methylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 2-tert-butyl-5-methyl-2-(2-methylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 2-tert-butyl-5-methyl-2-(o-tolyl)-1H-inden-1-ide; zirconium(2+); dichloride Formula: C21H23Cl2Zr- MolecularWeight: 437.53732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC([C-]=C2C=C1)(C3=CC=CC=C3C)C(C)(C)C.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CC1=CC2=CC([C-]=C2C=C1)(C3=CC=CC=C3C)C(C)(C)C.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C21H23.2ClH.Zr/c1-15-10-11-17-13-21(20(3,4)5,14-18(17)12-15)19-9-7-6-8-16(19)2;;;/h6-12,14H,1-5H3;2*1H;/q-1;;;+2/p-2