4-[[1-(4-methylsulfonyloxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methoxy]benzoic acid

Systemtic Name: 4-[[1-(4-methylsulfonyloxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]methoxy]benzoic acid Openeye Name: 4-[[1-(4-methylsulfonyloxyphenyl)-5-oxo-pyrrolidin-3-yl]methoxy]benzoic acid CAS Name: 4-[[1-(4-methylsulfonyloxyphenyl)-5-oxo-3-pyrrolidinyl]methoxy]benzoic acid IUPAC Name: 4-[[1-(4-methylsulfonyloxyphenyl)-5-oxopyrrolidin-3-yl]methoxy]benzoic acid Traditional Name: 4-[[5-keto-1-(4-methylsulfonyloxyphenyl)pyrrolidin-3-yl]methoxy]benzoic acid Formula: C19H19NO7S MolecularWeight: 405.42166

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC=C(C=C1)N2CC(CC2=O)COC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CS(=O)(=O)OC1=CC=C(C=C1)N2CC(CC2=O)COC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H19NO7S/c1-28(24,25)27-17-8-4-15(5-9-17)20-11-13(10-18(20)21)12-26-16-6-2-14(3-7-16)19(22)23/h2-9,13H,10-12H2,1H3,(H,22,23)