1-[5-(methylsulfanylmethyl)furan-2-yl]carbonyl-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[5-(methylsulfanylmethyl)furan-2-yl]carbonyl-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 4-hydroxy-1-[5-(methylsulfanylmethyl)furan-2-carbonyl]pyrrolidine-2-carboxylic acid CAS Name: 4-hydroxy-1-[[5-[(methylthio)methyl]-2-furanyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-hydroxy-1-[5-(methylsulfanylmethyl)furan-2-carbonyl]pyrrolidine-2-carboxylic acid Traditional Name: 4-hydroxy-1-[5-[(methylthio)methyl]-2-furoyl]proline Formula: C12H15NO5S MolecularWeight: 285.3162

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(O1)C(=O)N2CC(CC2C(=O)O)O

Isomeric SMILES

CSCC1=CC=C(O1)C(=O)N2CC(CC2C(=O)O)O

InChI

InChI=1S/C12H15NO5S/c1-19-6-8-2-3-10(18-8)11(15)13-5-7(14)4-9(13)12(16)17/h2-3,7,9,14H,4-6H2,1H3,(H,16,17)