(2S)-N-[[2-[2-azanyl-3,3-bis(fluoranyl)propyl]-5-chloranyl-phenyl]methyl]-1-(9-oxidanylfluoren-9-yl)carbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[[2-[2-azanyl-3,3-bis(fluoranyl)propyl]-5-chloranyl-phenyl]methyl]-1-(9-oxidanylfluoren-9-yl)carbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[[2-(2-amino-3,3-difluoro-propyl)-5-chloro-phenyl]methyl]-1-(9-hydroxyfluorene-9-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[[2-(2-amino-3,3-difluoropropyl)-5-chlorophenyl]methyl]-1-[(9-hydroxy-9-fluorenyl)-oxomethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[[2-(2-amino-3,3-difluoropropyl)-5-chlorophenyl]methyl]-1-(9-hydroxyfluorene-9-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[2-(2-amino-3,3-difluoro-propyl)-5-chloro-benzyl]-1-(9-hydroxyfluorene-9-carbonyl)pyrrolidine-2-carboxamide Formula: C29H28ClF2N3O3 MolecularWeight: 540.000726

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2(C3=CC=CC=C3C4=CC=CC=C42)O)C(=O)NCC5=C(C=CC(=C5)Cl)CC(C(F)F)N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2(C3=CC=CC=C3C4=CC=CC=C42)O)C(=O)NCC5=C(C=CC(=C5)Cl)CC(C(F)F)N

InChI

InChI=1S/C29H28ClF2N3O3/c30-19-12-11-17(15-24(33)26(31)32)18(14-19)16-34-27(36)25-10-5-13-35(25)28(37)29(38)22-8-3-1-6-20(22)21-7-2-4-9-23(21)29/h1-4,6-9,11-12,14,24-26,38H,5,10,13,15-16,33H2,(H,34,36)/t24?,25-/m0/s1