cyclopenta-1,3-diene; 1-methoxy-3-(trifluoromethyl)benzene-4-ide; titanium(3+); chloride

Systemtic Name: cyclopenta-1,3-diene; 1-methoxy-3-(trifluoromethyl)benzene-4-ide; titanium(3+); chloride Openeye Name: cyclopenta-1,3-diene; 1-methoxy-3-(trifluoromethyl)benzene-4-ide; titanium(3+); chloride CAS Name: cyclopenta-1,3-diene; 1-methoxy-3-(trifluoromethyl)benzene-4-ide; titanium(3+); chloride IUPAC Name: cyclopenta-1,3-diene; 1-methoxy-3-(trifluoromethyl)benzene-4-ide; titanium(3+); chloride Traditional Name: cyclopenta-1,3-diene; 1-methoxy-3-(trifluoromethyl)benzene-4-ide; titanium(3+); chloride Formula: C18H16ClF3OTi- MolecularWeight: 388.63425

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=[C-]C(=C1)C(F)(F)F.C1C=CC=[C-]1.C1C=CC=[C-]1.[Cl-].[Ti+3]

Isomeric SMILES

COC1=CC=[C-]C(=C1)C(F)(F)F.C1C=CC=[C-]1.C1C=CC=[C-]1.[Cl-].[Ti+3]

InChI

InChI=1S/C8H6F3O.2C5H5.ClH.Ti/c1-12-7-4-2-3-6(5-7)8(9,10)11;2*1-2-4-5-3-1;;/h2,4-5H,1H3;2*1-3H,4H2;1H;/q3*-1;;+3/p-1