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

Systemtic Name: 2-(4-phenyl-1H-inden-1-id-2-yl)-5-propyl-furan; zirconium(2+) Openeye Name: 2-(4-phenyl-1H-inden-1-id-2-yl)-5-propyl-furan; zirconium(2+) CAS Name: 2-(4-phenyl-1H-inden-1-id-2-yl)-5-propylfuran; zirconium(2+) IUPAC Name: 2-(4-phenyl-1H-inden-1-id-2-yl)-5-propylfuran; zirconium(2+) Traditional Name: 2-(4-phenyl-1H-inden-1-id-2-yl)-5-propyl-furan; zirconium(2+) Formula: C44H38O2Zr MolecularWeight: 689.99532

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C4=CC=CC=C4.CCCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C4=CC=CC=C4.[Zr+2]

Isomeric SMILES

CCCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C4=CC=CC=C4.CCCC1=CC=C(O1)C2=CC3=C([CH-]2)C=CC=C3C4=CC=CC=C4.[Zr+2]

InChI

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