4-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-butyl-2,7-bis(fluoranyl)-3-piperidin-1-yl-N-[2,2,2-tris(fluoranyl)ethyl]-9H-fluorene-9-carboxamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-butyl-2,7-bis(fluoranyl)-3-piperidin-1-yl-N-[2,2,2-tris(fluoranyl)ethyl]-9H-fluorene-9-carboxamide Openeye Name: 1-butyl-4-(1,3-dioxoisoindolin-2-yl)-2,7-difluoro-3-(1-piperidyl)-N-(2,2,2-trifluoroethyl)-9H-fluorene-9-carboxamide CAS Name: 1-butyl-4-(1,3-dioxo-2-isoindolyl)-2,7-difluoro-3-(1-piperidinyl)-N-(2,2,2-trifluoroethyl)-9H-fluorene-9-carboxamide IUPAC Name: 1-butyl-4-(1,3-dioxoisoindol-2-yl)-2,7-difluoro-3-piperidin-1-yl-N-(2,2,2-trifluoroethyl)-9H-fluorene-9-carboxamide Traditional Name: 1-butyl-2,7-difluoro-4-phthalimido-3-piperidino-N-(2,2,2-trifluoroethyl)-9H-fluorene-9-carboxamide Formula: C33H30F5N3O3 MolecularWeight: 611.601616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(C2=C1C(C3=C2C=CC(=C3)F)C(=O)NCC(F)(F)F)N4C(=O)C5=CC=CC=C5C4=O)N6CCCCC6)F

Isomeric SMILES

CCCCC1=C(C(=C(C2=C1C(C3=C2C=CC(=C3)F)C(=O)NCC(F)(F)F)N4C(=O)C5=CC=CC=C5C4=O)N6CCCCC6)F

InChI

InChI=1S/C33H30F5N3O3/c1-2-3-9-22-24-25(19-13-12-18(34)16-23(19)26(24)30(42)39-17-33(36,37)38)28(29(27(22)35)40-14-7-4-8-15-40)41-31(43)20-10-5-6-11-21(20)32(41)44/h5-6,10-13,16,26H,2-4,7-9,14-15,17H2,1H3,(H,39,42)