methyl (2S,4S,5R)-1-methyl-2-(2-methylpropyl)-4-(propylcarbamoyl)-5-pyridin-3-yl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4S,5R)-1-methyl-2-(2-methylpropyl)-4-(propylcarbamoyl)-5-pyridin-3-yl-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4S,5R)-2-isobutyl-1-methyl-4-(propylcarbamoyl)-5-(3-pyridyl)pyrrolidine-2-carboxylate CAS Name: (2S,4S,5R)-1-methyl-2-(2-methylpropyl)-4-[oxo(propylamino)methyl]-5-(3-pyridinyl)-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4S,5R)-1-methyl-2-(2-methylpropyl)-4-(propylcarbamoyl)-5-pyridin-3-ylpyrrolidine-2-carboxylate Traditional Name: (2S,4S,5R)-2-isobutyl-1-methyl-4-(propylcarbamoyl)-5-(3-pyridyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C20H31N3O3 MolecularWeight: 361.47844

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1CC(N(C1C2=CN=CC=C2)C)(CC(C)C)C(=O)OC

Isomeric SMILES

CCCNC(=O)[C@H]1C[C@@](N([C@H]1C2=CN=CC=C2)C)(CC(C)C)C(=O)OC

InChI

InChI=1S/C20H31N3O3/c1-6-9-22-18(24)16-12-20(11-14(2)3,19(25)26-5)23(4)17(16)15-8-7-10-21-13-15/h7-8,10,13-14,16-17H,6,9,11-12H2,1-5H3,(H,22,24)/t16-,17-,20-/m0/s1