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

Systemtic Name: 2-ethyl-5-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) Openeye Name: 2-ethyl-5-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) CAS Name: 2-ethyl-5-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) IUPAC Name: 2-ethyl-5-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) Traditional Name: 2-ethyl-5-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]furan; zirconium(2+) Formula: C46H42O2Zr MolecularWeight: 718.04848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC=CC3=C2C=C([CH-]3)C4=CC=C(O4)CC.CCC1=CC=C(C=C1)C2=CC=CC3=C2C=C([CH-]3)C4=CC=C(O4)CC.[Zr+2]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC=CC3=C2C=C([CH-]3)C4=CC=C(O4)CC.CCC1=CC=C(C=C1)C2=CC=CC3=C2C=C([CH-]3)C4=CC=C(O4)CC.[Zr+2]

InChI

InChI=1S/2C23H21O.Zr/c2*1-3-16-8-10-17(11-9-16)21-7-5-6-18-14-19(15-22(18)21)23-13-12-20(4-2)24-23;/h2*5-15H,3-4H2,1-2H3;/q2*-1;+2