N-butyl-4,4-bis(fluoranyl)-1-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]pyrrolidine-2-carboxamide

Systemtic Name: N-butyl-4,4-bis(fluoranyl)-1-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]pyrrolidine-2-carboxamide Openeye Name: N-butyl-4,4-difluoro-1-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]pyrrolidine-2-carboxamide CAS Name: N-butyl-4,4-difluoro-1-[2-hydroxy-3-[[(3-hydroxy-2-methylphenyl)-oxomethyl]amino]-1-oxo-4-phenylbutyl]-2-pyrrolidinecarboxamide IUPAC Name: N-butyl-4,4-difluoro-1-[2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylbutanoyl]pyrrolidine-2-carboxamide Traditional Name: N-butyl-4,4-difluoro-1-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-phenyl-butanoyl]pyrrolidine-2-carboxamide Formula: C27H33F2N3O5 MolecularWeight: 517.564826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CC(CN1C(=O)C(C(CC2=CC=CC=C2)NC(=O)C3=C(C(=CC=C3)O)C)O)(F)F

Isomeric SMILES

CCCCNC(=O)C1CC(CN1C(=O)C(C(CC2=CC=CC=C2)NC(=O)C3=C(C(=CC=C3)O)C)O)(F)F

InChI

InChI=1S/C27H33F2N3O5/c1-3-4-13-30-25(36)21-15-27(28,29)16-32(21)26(37)23(34)20(14-18-9-6-5-7-10-18)31-24(35)19-11-8-12-22(33)17(19)2/h5-12,20-21,23,33-34H,3-4,13-16H2,1-2H3,(H,30,36)(H,31,35)