2-(4-tert-butyl-1H-inden-1-id-2-yl)-5-propyl-furan; zirconium(2+)

Systemtic Name: 2-(4-tert-butyl-1H-inden-1-id-2-yl)-5-propyl-furan; zirconium(2+) Openeye Name: 2-(4-tert-butyl-1H-inden-1-id-2-yl)-5-propyl-furan; zirconium(2+) CAS Name: 2-(4-tert-butyl-1H-inden-1-id-2-yl)-5-propylfuran; zirconium(2+) IUPAC Name: 2-(4-tert-butyl-1H-inden-1-id-2-yl)-5-propylfuran; zirconium(2+) Traditional Name: 2-(4-tert-butyl-1H-inden-1-id-2-yl)-5-propyl-furan; zirconium(2+) Formula: C40H46O2Zr MolecularWeight: 650.01604

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C(C)(C)C.CCCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C(C)(C)C.[Zr+2]

Isomeric SMILES

CCCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C(C)(C)C.CCCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C(C)(C)C.[Zr+2]

InChI

InChI=1S/2C20H23O.Zr/c2*1-5-7-16-10-11-19(21-16)15-12-14-8-6-9-18(17(14)13-15)20(2,3)4;/h2*6,8-13H,5,7H2,1-4H3;/q2*-1;+2