1-[3-[(4-methoxyphenyl)methylsulfanyl]-2-methyl-propanoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-[(4-methoxyphenyl)methylsulfanyl]-2-methyl-propanoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 4-hydroxy-1-[3-[(4-methoxyphenyl)methylsulfanyl]-2-methyl-propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 4-hydroxy-1-[3-[(4-methoxyphenyl)methylthio]-2-methyl-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-hydroxy-1-[3-[(4-methoxyphenyl)methylsulfanyl]-2-methylpropanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 4-hydroxy-1-[2-methyl-3-(p-anisylthio)propanoyl]proline Formula: C17H23NO5S MolecularWeight: 353.43322

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCC1=CC=C(C=C1)OC)C(=O)N2CC(CC2C(=O)O)O

Isomeric SMILES

CC(CSCC1=CC=C(C=C1)OC)C(=O)N2CC(CC2C(=O)O)O

InChI

InChI=1S/C17H23NO5S/c1-11(9-24-10-12-3-5-14(23-2)6-4-12)16(20)18-8-13(19)7-15(18)17(21)22/h3-6,11,13,15,19H,7-10H2,1-2H3,(H,21,22)