1-[3-[(2,4-dimethyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]-4,4-bis(fluoranyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-[(2,4-dimethyl-3-oxidanyl-phenyl)carbonylamino]-2-oxidanyl-4-phenyl-butanoyl]-4,4-bis(fluoranyl)pyrrolidine-2-carboxylic acid Openeye Name: 4,4-difluoro-1-[2-hydroxy-3-[(3-hydroxy-2,4-dimethyl-benzoyl)amino]-4-phenyl-butanoyl]pyrrolidine-2-carboxylic acid CAS Name: 4,4-difluoro-1-[2-hydroxy-3-[[(3-hydroxy-2,4-dimethylphenyl)-oxomethyl]amino]-1-oxo-4-phenylbutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4,4-difluoro-1-[2-hydroxy-3-[(3-hydroxy-2,4-dimethylbenzoyl)amino]-4-phenylbutanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 4,4-difluoro-1-[2-hydroxy-3-[(3-hydroxy-2,4-dimethyl-benzoyl)amino]-4-phenyl-butanoyl]proline Formula: C24H26F2N2O6 MolecularWeight: 476.469846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(C(=O)N3CC(CC3C(=O)O)(F)F)O)C)O

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)NC(CC2=CC=CC=C2)C(C(=O)N3CC(CC3C(=O)O)(F)F)O)C)O

InChI

InChI=1S/C24H26F2N2O6/c1-13-8-9-16(14(2)19(13)29)21(31)27-17(10-15-6-4-3-5-7-15)20(30)22(32)28-12-24(25,26)11-18(28)23(33)34/h3-9,17-18,20,29-30H,10-12H2,1-2H3,(H,27,31)(H,33,34)