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

Systemtic Name: 2-methyl-5-[4-(4-propylphenyl)-1,2-dihydroinden-2-id-1-yl]furan; zirconium(2+) Openeye Name: 2-methyl-5-[4-(4-propylphenyl)-1,2-dihydroinden-2-id-1-yl]furan; zirconium(2+) CAS Name: 2-methyl-5-[4-(4-propylphenyl)-1,2-dihydroinden-2-id-1-yl]furan; zirconium(2+) IUPAC Name: 2-methyl-5-[4-(4-propylphenyl)-1,2-dihydroinden-2-id-1-yl]furan; zirconium(2+) Traditional Name: 2-methyl-5-[4-(4-propylphenyl)-1,2-dihydroinden-2-id-1-yl]furan; zirconium(2+) Formula: C46H42O2Zr MolecularWeight: 718.04848

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=C3C=[C-]C(C3=CC=C2)C4=CC=C(O4)C.CCCC1=CC=C(C=C1)C2=C3C=[C-]C(C3=CC=C2)C4=CC=C(O4)C.[Zr+2]

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=C3C=[C-]C(C3=CC=C2)C4=CC=C(O4)C.CCCC1=CC=C(C=C1)C2=C3C=[C-]C(C3=CC=C2)C4=CC=C(O4)C.[Zr+2]

InChI

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