4-ethanoylsulfanyl-1-(4-methoxyphenyl)sulfonyl-2-methyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 4-ethanoylsulfanyl-1-(4-methoxyphenyl)sulfonyl-2-methyl-pyrrolidine-2-carboxylic acid Openeye Name: 4-acetylsulfanyl-1-(4-methoxyphenyl)sulfonyl-2-methyl-pyrrolidine-2-carboxylic acid CAS Name: 4-(acetylthio)-1-(4-methoxyphenyl)sulfonyl-2-methyl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-acetylsulfanyl-1-(4-methoxyphenyl)sulfonyl-2-methylpyrrolidine-2-carboxylic acid Traditional Name: 4-(acetylthio)-1-(4-methoxyphenyl)sulfonyl-2-methyl-proline Formula: C15H19NO6S2 MolecularWeight: 373.44446

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)OC)(C)C(=O)O

Isomeric SMILES

CC(=O)SC1CC(N(C1)S(=O)(=O)C2=CC=C(C=C2)OC)(C)C(=O)O

InChI

InChI=1S/C15H19NO6S2/c1-10(17)23-12-8-15(2,14(18)19)16(9-12)24(20,21)13-6-4-11(22-3)5-7-13/h4-7,12H,8-9H2,1-3H3,(H,18,19)