2-ethyl-5-phenyl-2-(2-propan-2-ylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 2-ethyl-5-phenyl-2-(2-propan-2-ylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 2-ethyl-2-(2-isopropylphenyl)-5-phenyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 2-ethyl-5-phenyl-2-(2-propan-2-ylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 2-ethyl-5-phenyl-2-(2-propan-2-ylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 2-ethyl-2-o-cumenyl-5-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C26H25Cl2Zr- MolecularWeight: 499.6067

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C=C2C=C(C=CC2=[C-]1)C3=CC=CC=C3)C4=CC=CC=C4C(C)C.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CCC1(C=C2C=C(C=CC2=[C-]1)C3=CC=CC=C3)C4=CC=CC=C4C(C)C.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C26H25.2ClH.Zr/c1-4-26(25-13-9-8-12-24(25)19(2)3)17-22-15-14-21(16-23(22)18-26)20-10-6-5-7-11-20;;;/h5-16,18-19H,4H2,1-3H3;2*1H;/q-1;;;+2/p-2