1-(3-ethoxycarbonylsulfanylbutanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-ethoxycarbonylsulfanylbutanoyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-ethoxycarbonylsulfanylbutanoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(ethoxycarbonylthio)-1-oxobutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-ethoxycarbonylsulfanylbutanoyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(carbethoxythio)butanoyl]proline Formula: C12H19NO5S MolecularWeight: 289.34796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)SC(C)CC(=O)N1CCCC1C(=O)O

Isomeric SMILES

CCOC(=O)SC(C)CC(=O)N1CCCC1C(=O)O

InChI

InChI=1S/C12H19NO5S/c1-3-18-12(17)19-8(2)7-10(14)13-6-4-5-9(13)11(15)16/h8-9H,3-7H2,1-2H3,(H,15,16)