4-fluoranylphenol; 1H-inden-1-ide; propan-2-ylidenezirconium

Systemtic Name: 4-fluoranylphenol; 1H-inden-1-ide; propan-2-ylidenezirconium Openeye Name: 4-fluorophenol; 1H-inden-1-ide; isopropylidenezirconium CAS Name: 4-fluorophenol; 1H-inden-1-ide; propan-2-ylidenezirconium IUPAC Name: 4-fluorophenol; 1H-inden-1-ide; propan-2-ylidenezirconium Traditional Name: 4-fluorophenol; 1H-inden-1-ide; isopropylidenezirconium Formula: C33H30F2O2Zr-2 MolecularWeight: 587.810906

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[Zr])C.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.C1=CC(=CC=C1O)F.C1=CC(=CC=C1O)F

Isomeric SMILES

CC(=[Zr])C.[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=CC=CC=C21.C1=CC(=CC=C1O)F.C1=CC(=CC=C1O)F

InChI

InChI=1S/2C9H7.2C6H5FO.C3H6.Zr/c2*1-2-5-9-7-3-6-8(9)4-1;2*7-5-1-3-6(8)4-2-5;1-3-2;/h2*1-7H;2*1-4,8H;1-2H3;/q2*-1;;;;