methyl 4-[[1-(4-methylsulfonyloxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methoxy]benzoate

Systemtic Name: methyl 4-[[1-(4-methylsulfonyloxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methoxy]benzoate Openeye Name: methyl 4-[[1-(4-methylsulfonyloxyphenyl)-5-oxo-pyrrolidin-3-yl]methoxy]benzoate CAS Name: 4-[[1-(4-methylsulfonyloxyphenyl)-5-oxo-3-pyrrolidinyl]methoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(4-methylsulfonyloxyphenyl)-5-oxopyrrolidin-3-yl]methoxy]benzoate Traditional Name: 4-[[5-keto-1-(4-methylsulfonyloxyphenyl)pyrrolidin-3-yl]methoxy]benzoic acid methyl ester Formula: C20H21NO7S MolecularWeight: 419.44824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC2CC(=O)N(C2)C3=CC=C(C=C3)OS(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC2CC(=O)N(C2)C3=CC=C(C=C3)OS(=O)(=O)C

InChI

InChI=1S/C20H21NO7S/c1-26-20(23)15-3-7-17(8-4-15)27-13-14-11-19(22)21(12-14)16-5-9-18(10-6-16)28-29(2,24)25/h3-10,14H,11-13H2,1-2H3