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

Systemtic Name: 2-methyl-5-[4-(4-methylphenyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) Openeye Name: 2-methyl-5-[4-(p-tolyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) CAS Name: 2-methyl-5-[4-(4-methylphenyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) IUPAC Name: 2-methyl-5-[4-(4-methylphenyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) Traditional Name: 2-methyl-5-[4-(p-tolyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) Formula: C42H34O2Zr MolecularWeight: 661.94216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=CC3=C2C=C([CH-]3)C4=CC=C(O4)C.CC1=CC=C(C=C1)C2=CC=CC3=C2C=C([CH-]3)C4=CC=C(O4)C.[Zr+2]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=CC3=C2C=C([CH-]3)C4=CC=C(O4)C.CC1=CC=C(C=C1)C2=CC=CC3=C2C=C([CH-]3)C4=CC=C(O4)C.[Zr+2]

InChI

InChI=1S/2C21H17O.Zr/c2*1-14-6-9-16(10-7-14)19-5-3-4-17-12-18(13-20(17)19)21-11-8-15(2)22-21;/h2*3-13H,1-2H3;/q2*-1;+2