3-[2,4-bis(fluoranyl)benzene-3-id-1-yl]-1,1-dimethyl-urea; cyclopenta-1,3-diene; titanium(4+)

Systemtic Name: 3-[2,4-bis(fluoranyl)benzene-3-id-1-yl]-1,1-dimethyl-urea; cyclopenta-1,3-diene; titanium(4+) Openeye Name: cyclopenta-1,3-diene; 3-(2,4-difluorobenzene-3-id-1-yl)-1,1-dimethyl-urea; titanium(4+) CAS Name: cyclopenta-1,3-diene; 3-(2,4-difluoro-1-benzene-3-idyl)-1,1-dimethylurea; titanium(4+) IUPAC Name: cyclopenta-1,3-diene; 3-(2,4-difluorobenzene-3-id-1-yl)-1,1-dimethylurea; titanium(4+) Traditional Name: cyclopenta-1,3-diene; 3-(2,4-difluorobenzene-3-id-1-yl)-1,1-dimethyl-urea; titanium(4+) Formula: C28H28F4N4O2Ti MolecularWeight: 576.408133

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC1=C([C-]=C(C=C1)F)F.CN(C)C(=O)NC1=C([C-]=C(C=C1)F)F.C1C=CC=[C-]1.C1C=CC=[C-]1.[Ti+4]

Isomeric SMILES

CN(C)C(=O)NC1=C([C-]=C(C=C1)F)F.CN(C)C(=O)NC1=C([C-]=C(C=C1)F)F.C1C=CC=[C-]1.C1C=CC=[C-]1.[Ti+4]

InChI

InChI=1S/2C9H9F2N2O.2C5H5.Ti/c2*1-13(2)9(14)12-8-4-3-6(10)5-7(8)11;2*1-2-4-5-3-1;/h2*3-4H,1-2H3,(H,12,14);2*1-3H,4H2;/q4*-1;+4