1-(3-ethanoylsulfanylpropanoyl)-4-oxidanyl-4-(1-phenylpropyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-ethanoylsulfanylpropanoyl)-4-oxidanyl-4-(1-phenylpropyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-acetylsulfanylpropanoyl)-4-hydroxy-4-(1-phenylpropyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(acetylthio)-1-oxopropyl]-4-hydroxy-4-(1-phenylpropyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-acetylsulfanylpropanoyl)-4-hydroxy-4-(1-phenylpropyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(acetylthio)propanoyl]-4-hydroxy-4-(1-phenylpropyl)proline Formula: C19H25NO5S MolecularWeight: 379.4705

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C2(CC(N(C2)C(=O)CCSC(=O)C)C(=O)O)O

Isomeric SMILES

CCC(C1=CC=CC=C1)C2(CC(N(C2)C(=O)CCSC(=O)C)C(=O)O)O

InChI

InChI=1S/C19H25NO5S/c1-3-15(14-7-5-4-6-8-14)19(25)11-16(18(23)24)20(12-19)17(22)9-10-26-13(2)21/h4-8,15-16,25H,3,9-12H2,1-2H3,(H,23,24)