2-ethyl-5-[4-(4-methylphenyl)-1H-inden-1-id-2-yl]furan; zirconium(2+)

Systemtic Name: 2-ethyl-5-[4-(4-methylphenyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) Openeye Name: 2-ethyl-5-[4-(p-tolyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) CAS Name: 2-ethyl-5-[4-(4-methylphenyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) IUPAC Name: 2-ethyl-5-[4-(4-methylphenyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) Traditional Name: 2-ethyl-5-[4-(p-tolyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) Formula: C44H38O2Zr MolecularWeight: 689.99532

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C4=CC=C(C=C4)C.CCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C4=CC=C(C=C4)C.[Zr+2]

Isomeric SMILES

CCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C4=CC=C(C=C4)C.CCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C4=CC=C(C=C4)C.[Zr+2]

InChI

InChI=1S/2C22H19O.Zr/c2*1-3-19-11-12-22(23-19)18-13-17-5-4-6-20(21(17)14-18)16-9-7-15(2)8-10-16;/h2*4-14H,3H2,1-2H3;/q2*-1;+2