2-methyl-5-(4-phenyl-1,2-dihydroinden-2-id-1-yl)furan; zirconium(2+)

Systemtic Name: 2-methyl-5-(4-phenyl-1,2-dihydroinden-2-id-1-yl)furan; zirconium(2+) Openeye Name: 2-methyl-5-(4-phenyl-1,2-dihydroinden-2-id-1-yl)furan; zirconium(2+) CAS Name: 2-methyl-5-(4-phenyl-1,2-dihydroinden-2-id-1-yl)furan; zirconium(2+) IUPAC Name: 2-methyl-5-(4-phenyl-1,2-dihydroinden-2-id-1-yl)furan; zirconium(2+) Traditional Name: 2-methyl-5-(4-phenyl-1,2-dihydroinden-2-id-1-yl)furan; zirconium(2+) Formula: C40H30O2Zr MolecularWeight: 633.889

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2[C-]=CC3=C(C=CC=C23)C4=CC=CC=C4.CC1=CC=C(O1)C2[C-]=CC3=C(C=CC=C23)C4=CC=CC=C4.[Zr+2]

Isomeric SMILES

CC1=CC=C(O1)C2[C-]=CC3=C(C=CC=C23)C4=CC=CC=C4.CC1=CC=C(O1)C2[C-]=CC3=C(C=CC=C23)C4=CC=CC=C4.[Zr+2]

InChI

InChI=1S/2C20H15O.Zr/c2*1-14-10-13-20(21-14)19-12-11-18-16(8-5-9-17(18)19)15-6-3-2-4-7-15;/h2*2-11,13,19H,1H3;/q2*-1;+2