(3-ethanoylsulfanyl-2-methyl-propanoyl) (2S,4R)-4-(2-methoxyphenyl)pyrrolidine-2-carboxylate

Systemtic Name: (3-ethanoylsulfanyl-2-methyl-propanoyl) (2S,4R)-4-(2-methoxyphenyl)pyrrolidine-2-carboxylate Openeye Name: (3-acetylsulfanyl-2-methyl-propanoyl) (2S,4R)-4-(2-methoxyphenyl)pyrrolidine-2-carboxylate CAS Name: (2S,4R)-4-(2-methoxyphenyl)-2-pyrrolidinecarboxylic acid [3-(acetylthio)-2-methyl-1-oxopropyl] ester IUPAC Name: (3-acetylsulfanyl-2-methylpropanoyl) (2S,4R)-4-(2-methoxyphenyl)pyrrolidine-2-carboxylate Traditional Name: (2S,4R)-4-(2-methoxyphenyl)pyrrolidine-2-carboxylic acid [3-(acetylthio)-2-methyl-propanoyl] ester Formula: C18H23NO5S MolecularWeight: 365.44392

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)OC(=O)C1CC(CN1)C2=CC=CC=C2OC

Isomeric SMILES

CC(CSC(=O)C)C(=O)OC(=O)[C@@H]1C[C@@H](CN1)C2=CC=CC=C2OC

InChI

InChI=1S/C18H23NO5S/c1-11(10-25-12(2)20)17(21)24-18(22)15-8-13(9-19-15)14-6-4-5-7-16(14)23-3/h4-7,11,13,15,19H,8-10H2,1-3H3/t11?,13-,15-/m0/s1