9-[(E)-4-[5-[[2-[4-(trifluoromethyl)phenyl]phenyl]carbonylamino]pyridin-2-yl]but-3-enyl]-N-[2,2,2-tris(fluoranyl)ethyl]fluorene-9-carboxamide

Systemtic Name: 9-[(E)-4-[5-[[2-[4-(trifluoromethyl)phenyl]phenyl]carbonylamino]pyridin-2-yl]but-3-enyl]-N-[2,2,2-tris(fluoranyl)ethyl]fluorene-9-carboxamide Openeye Name: N-(2,2,2-trifluoroethyl)-9-[(E)-4-[5-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]-2-pyridyl]but-3-enyl]fluorene-9-carboxamide CAS Name: 9-[(E)-4-[5-[[oxo-[2-[4-(trifluoromethyl)phenyl]phenyl]methyl]amino]-2-pyridinyl]but-3-enyl]-N-(2,2,2-trifluoroethyl)-9-fluorenecarboxamide IUPAC Name: N-(2,2,2-trifluoroethyl)-9-[(E)-4-[5-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]pyridin-2-yl]but-3-enyl]fluorene-9-carboxamide Traditional Name: N-(2,2,2-trifluoroethyl)-9-[(E)-4-[5-[[2-[4-(trifluoromethyl)phenyl]benzoyl]amino]-2-pyridyl]but-3-enyl]fluorene-9-carboxamide Formula: C39H29F6N3O2 MolecularWeight: 685.656879

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)C(F)(F)F)C(=O)NC3=CN=C(C=C3)C=CCCC4(C5=CC=CC=C5C6=CC=CC=C64)C(=O)NCC(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)C(F)(F)F)C(=O)NC3=CN=C(C=C3)/C=C/CCC4(C5=CC=CC=C5C6=CC=CC=C64)C(=O)NCC(F)(F)F

InChI

InChI=1S/C39H29F6N3O2/c40-38(41,42)24-47-36(50)37(33-14-5-3-11-30(33)31-12-4-6-15-34(31)37)22-8-7-9-27-20-21-28(23-46-27)48-35(49)32-13-2-1-10-29(32)25-16-18-26(19-17-25)39(43,44)45/h1-7,9-21,23H,8,22,24H2,(H,47,50)(H,48,49)/b9-7+