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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C([C-]=C(C=C1)F)F.CCCCNC1=C([C-]=C(C=C1)F)F.C1C=CC=[C-]1.C1C=CC=[C-]1.[Ti+4]

Isomeric SMILES

CCCCNC1=C([C-]=C(C=C1)F)F.CCCCNC1=C([C-]=C(C=C1)F)F.C1C=CC=[C-]1.C1C=CC=[C-]1.[Ti+4]

InChI

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