methyl 3-methylsulfonyl-5-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: methyl 3-methylsulfonyl-5-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: methyl 3-methylsulfonyl-5-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 3-methylsulfonyl-5-(2-oxo-1-pyrrolidinyl)benzoic acid methyl ester IUPAC Name: methyl 3-methylsulfonyl-5-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 3-(2-ketopyrrolidino)-5-mesyl-benzoic acid methyl ester Formula: C13H15NO5S MolecularWeight: 297.3269

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)C)N2CCCC2=O

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)S(=O)(=O)C)N2CCCC2=O

InChI

InChI=1S/C13H15NO5S/c1-19-13(16)9-6-10(14-5-3-4-12(14)15)8-11(7-9)20(2,17)18/h6-8H,3-5H2,1-2H3