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

Systemtic Name: 1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-3-phenoxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-acetylsulfanyl-2-methyl-propanoyl)-3-phenoxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(acetylthio)-2-methyl-1-oxopropyl]-3-phenoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-acetylsulfanyl-2-methylpropanoyl)-3-phenoxypyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(acetylthio)-2-methyl-propanoyl]-3-phenoxy-proline Formula: C17H21NO5S MolecularWeight: 351.41734

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N1CCC(C1C(=O)O)OC2=CC=CC=C2

Isomeric SMILES

CC(CSC(=O)C)C(=O)N1CCC(C1C(=O)O)OC2=CC=CC=C2

InChI

InChI=1S/C17H21NO5S/c1-11(10-24-12(2)19)16(20)18-9-8-14(15(18)17(21)22)23-13-6-4-3-5-7-13/h3-7,11,14-15H,8-10H2,1-2H3,(H,21,22)