2-ethyl-5-(2-propan-2-yl-1H-inden-1-id-2-yl)furan; zirconium(2+); dichloride

Systemtic Name: 2-ethyl-5-(2-propan-2-yl-1H-inden-1-id-2-yl)furan; zirconium(2+); dichloride Openeye Name: 2-ethyl-5-(2-isopropyl-1H-inden-1-id-2-yl)furan; zirconium(2+); dichloride CAS Name: 2-ethyl-5-(2-propan-2-yl-1H-inden-1-id-2-yl)furan; zirconium(2+); dichloride IUPAC Name: 2-ethyl-5-(2-propan-2-yl-1H-inden-1-id-2-yl)furan; zirconium(2+); dichloride Traditional Name: 2-ethyl-5-(2-isopropyl-1H-inden-1-id-2-yl)furan; zirconium(2+); dichloride Formula: C36H38Cl2O2Zr-2 MolecularWeight: 664.81572

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)C2(C=C3C=CC=CC3=[C-]2)C(C)C.CCC1=CC=C(O1)C2(C=C3C=CC=CC3=[C-]2)C(C)C.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CCC1=CC=C(O1)C2(C=C3C=CC=CC3=[C-]2)C(C)C.CCC1=CC=C(O1)C2(C=C3C=CC=CC3=[C-]2)C(C)C.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/2C18H19O.2ClH.Zr/c2*1-4-16-9-10-17(19-16)18(13(2)3)11-14-7-5-6-8-15(14)12-18;;;/h2*5-11,13H,4H2,1-3H3;2*1H;/q2*-1;;;+2/p-2