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

Systemtic Name: N-[2,4-bis(fluoranyl)benzene-3-id-1-yl]-3-chloranyl-2,2-dimethyl-3-phenyl-hexanamide; cyclopenta-1,3-diene; titanium(4+) Openeye Name: 3-chloro-N-(2,4-difluorobenzene-3-id-1-yl)-2,2-dimethyl-3-phenyl-hexanamide; cyclopenta-1,3-diene; titanium(4+) CAS Name: 3-chloro-N-(2,4-difluoro-1-benzene-3-idyl)-2,2-dimethyl-3-phenylhexanamide; cyclopenta-1,3-diene; titanium(4+) IUPAC Name: 3-chloro-N-(2,4-difluorobenzene-3-id-1-yl)-2,2-dimethyl-3-phenylhexanamide; cyclopenta-1,3-diene; titanium(4+) Traditional Name: 3-chloro-N-(2,4-difluorobenzene-3-id-1-yl)-2,2-dimethyl-3-phenyl-hexanamide; cyclopenta-1,3-diene; titanium(4+) Formula: C50H52Cl2F4N2O2Ti MolecularWeight: 907.726693

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)(C(C)(C)C(=O)NC2=C([C-]=C(C=C2)F)F)Cl.CCCC(C1=CC=CC=C1)(C(C)(C)C(=O)NC2=C([C-]=C(C=C2)F)F)Cl.C1C=CC=[C-]1.C1C=CC=[C-]1.[Ti+4]

Isomeric SMILES

CCCC(C1=CC=CC=C1)(C(C)(C)C(=O)NC2=C([C-]=C(C=C2)F)F)Cl.CCCC(C1=CC=CC=C1)(C(C)(C)C(=O)NC2=C([C-]=C(C=C2)F)F)Cl.C1C=CC=[C-]1.C1C=CC=[C-]1.[Ti+4]

InChI

InChI=1S/2C20H21ClF2NO.2C5H5.Ti/c2*1-4-12-20(21,14-8-6-5-7-9-14)19(2,3)18(25)24-17-11-10-15(22)13-16(17)23;2*1-2-4-5-3-1;/h2*5-11H,4,12H2,1-3H3,(H,24,25);2*1-3H,4H2;/q4*-1;+4