2,4-bis(fluoranyl)-1-propoxy-benzene-3-ide; cyclopenta-1,3-diene; titanium(4+)

Systemtic Name: 2,4-bis(fluoranyl)-1-propoxy-benzene-3-ide; cyclopenta-1,3-diene; titanium(4+) Openeye Name: cyclopenta-1,3-diene; 2,4-difluoro-1-propoxy-benzene-3-ide; titanium(4+) CAS Name: cyclopenta-1,3-diene; 2,4-difluoro-1-propoxybenzene-3-ide; titanium(4+) IUPAC Name: cyclopenta-1,3-diene; 2,4-difluoro-1-propoxybenzene-3-ide; titanium(4+) Traditional Name: cyclopenta-1,3-diene; 2,4-difluoro-1-propoxy-benzene-3-ide; titanium(4+) Formula: C28H28F4O2Ti MolecularWeight: 520.381333

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C([C-]=C(C=C1)F)F.CCCOC1=C([C-]=C(C=C1)F)F.C1C=CC=[C-]1.C1C=CC=[C-]1.[Ti+4]

Isomeric SMILES

CCCOC1=C([C-]=C(C=C1)F)F.CCCOC1=C([C-]=C(C=C1)F)F.C1C=CC=[C-]1.C1C=CC=[C-]1.[Ti+4]

InChI

InChI=1S/2C9H9F2O.2C5H5.Ti/c2*1-2-5-12-9-4-3-7(10)6-8(9)11;2*1-2-4-5-3-1;/h2*3-4H,2,5H2,1H3;2*1-3H,4H2;/q4*-1;+4