dimethyl 5-[[(2S)-3-methyl-1-oxidanylidene-1-[(2S)-2-[[1,1,1-tris(fluoranyl)-4-methyl-2-oxidanyl-pentan-3-yl]carbamoyl]pyrrolidin-1-yl]butan-2-yl]carbamoyl]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[(2S)-3-methyl-1-oxidanylidene-1-[(2S)-2-[[1,1,1-tris(fluoranyl)-4-methyl-2-oxidanyl-pentan-3-yl]carbamoyl]pyrrolidin-1-yl]butan-2-yl]carbamoyl]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[(1S)-2-methyl-1-[(2S)-2-[(3,3,3-trifluoro-2-hydroxy-1-isopropyl-propyl)carbamoyl]pyrrolidine-1-carbonyl]propyl]carbamoyl]benzene-1,3-dicarboxylate CAS Name: 5-[[[(2S)-3-methyl-1-oxo-1-[(2S)-2-[oxo-[(1,1,1-trifluoro-2-hydroxy-4-methylpentan-3-yl)amino]methyl]-1-pyrrolidinyl]butan-2-yl]amino]-oxomethyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[(2S)-3-methyl-1-oxo-1-[(2S)-2-[(1,1,1-trifluoro-2-hydroxy-4-methylpentan-3-yl)carbamoyl]pyrrolidin-1-yl]butan-2-yl]carbamoyl]benzene-1,3-dicarboxylate Traditional Name: 5-[[(1S)-2-methyl-1-[(2S)-2-[(3,3,3-trifluoro-2-hydroxy-1-isopropyl-propyl)carbamoyl]pyrrolidine-1-carbonyl]propyl]carbamoyl]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C27H36F3N3O8 MolecularWeight: 587.58525

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C(F)(F)F)O)NC(=O)C1CCCN1C(=O)C(C(C)C)NC(=O)C2=CC(=CC(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC[C@H]1C(=O)NC(C(C)C)C(C(F)(F)F)O)NC(=O)C2=CC(=CC(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C27H36F3N3O8/c1-13(2)19(21(34)27(28,29)30)31-23(36)18-8-7-9-33(18)24(37)20(14(3)4)32-22(35)15-10-16(25(38)40-5)12-17(11-15)26(39)41-6/h10-14,18-21,34H,7-9H2,1-6H3,(H,31,36)(H,32,35)/t18-,19?,20-,21?/m0/s1