(2S,4S)-1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-4-(2-methoxyphenyl)carbonyloxy-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S)-1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-4-(2-methoxyphenyl)carbonyloxy-pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S)-1-(3-acetylsulfanyl-2-methyl-propanoyl)-4-(2-methoxybenzoyl)oxy-pyrrolidine-2-carboxylic acid CAS Name: (2S,4S)-1-[3-(acetylthio)-2-methyl-1-oxopropyl]-4-[(2-methoxyphenyl)-oxomethoxy]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-1-(3-acetylsulfanyl-2-methylpropanoyl)-4-(2-methoxybenzoyl)oxypyrrolidine-2-carboxylic acid Traditional Name: (2S,4S)-1-[3-(acetylthio)-2-methyl-propanoyl]-4-o-anisoyloxy-proline Formula: C19H23NO7S MolecularWeight: 409.45342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N1CC(CC1C(=O)O)OC(=O)C2=CC=CC=C2OC

Isomeric SMILES

CC(CSC(=O)C)C(=O)N1C[C@H](C[C@H]1C(=O)O)OC(=O)C2=CC=CC=C2OC

InChI

InChI=1S/C19H23NO7S/c1-11(10-28-12(2)21)17(22)20-9-13(8-15(20)18(23)24)27-19(25)14-6-4-5-7-16(14)26-3/h4-7,11,13,15H,8-10H2,1-3H3,(H,23,24)/t11?,13-,15-/m0/s1