2,4-bis(fluoranyl)-N-(2-methylpropyl)benzene-3-id-1-amine; cyclopenta-1,3-diene; titanium(4+)

Systemtic Name: 2,4-bis(fluoranyl)-N-(2-methylpropyl)benzene-3-id-1-amine; cyclopenta-1,3-diene; titanium(4+) Openeye Name: cyclopenta-1,3-diene; 2,4-difluoro-N-isobutyl-benzene-3-id-1-amine; titanium(4+) CAS Name: cyclopenta-1,3-diene; 2,4-difluoro-N-(2-methylpropyl)-1-benzene-3-idamine; titanium(4+) IUPAC Name: cyclopenta-1,3-diene; 2,4-difluoro-N-(2-methylpropyl)benzene-3-id-1-amine; titanium(4+) Traditional Name: cyclopenta-1,3-diene; (2,4-difluorobenzene-3-id-1-yl)-isobutyl-amine; titanium(4+) Formula: C30H34F4N2Ti MolecularWeight: 546.464973

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=C([C-]=C(C=C1)F)F.CC(C)CNC1=C([C-]=C(C=C1)F)F.C1C=CC=[C-]1.C1C=CC=[C-]1.[Ti+4]

Isomeric SMILES

CC(C)CNC1=C([C-]=C(C=C1)F)F.CC(C)CNC1=C([C-]=C(C=C1)F)F.C1C=CC=[C-]1.C1C=CC=[C-]1.[Ti+4]

InChI

InChI=1S/2C10H12F2N.2C5H5.Ti/c2*1-7(2)6-13-10-4-3-8(11)5-9(10)12;2*1-2-4-5-3-1;/h2*3-4,7,13H,6H2,1-2H3;2*1-3H,4H2;/q4*-1;+4