1-[2-(ethanoylsulfanylmethyl)-4-methoxy-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(ethanoylsulfanylmethyl)-4-methoxy-4-oxidanylidene-butanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(acetylsulfanylmethyl)-4-methoxy-4-oxo-butanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(acetylthio)methyl]-4-methoxy-1,4-dioxobutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(acetylsulfanylmethyl)-4-methoxy-4-oxobutanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(acetylthio)methyl]-4-keto-4-methoxy-butanoyl]proline Formula: C13H19NO6S MolecularWeight: 317.35806

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CC(=O)OC)C(=O)N1CCCC1C(=O)O

Isomeric SMILES

CC(=O)SCC(CC(=O)OC)C(=O)N1CCCC1C(=O)O

InChI

InChI=1S/C13H19NO6S/c1-8(15)21-7-9(6-11(16)20-2)12(17)14-5-3-4-10(14)13(18)19/h9-10H,3-7H2,1-2H3,(H,18,19)