1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-4-propoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-4-propoxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-acetylsulfanyl-2-methyl-propanoyl)-4-propoxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(acetylthio)-2-methyl-1-oxopropyl]-4-propoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-acetylsulfanyl-2-methylpropanoyl)-4-propoxypyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(acetylthio)-2-methyl-propanoyl]-4-propoxy-proline Formula: C14H23NO5S MolecularWeight: 317.40112

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1CC(N(C1)C(=O)C(C)CSC(=O)C)C(=O)O

Isomeric SMILES

CCCOC1CC(N(C1)C(=O)C(C)CSC(=O)C)C(=O)O

InChI

InChI=1S/C14H23NO5S/c1-4-5-20-11-6-12(14(18)19)15(7-11)13(17)9(2)8-21-10(3)16/h9,11-12H,4-8H2,1-3H3,(H,18,19)