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

Systemtic Name: 4-[[5-oxidanylidene-1-[4-(phenylsulfonyloxy)phenyl]pyrrolidin-3-yl]methoxy]benzoic acid Openeye Name: 4-[[1-[4-(benzenesulfonyloxy)phenyl]-5-oxo-pyrrolidin-3-yl]methoxy]benzoic acid CAS Name: 4-[[1-[4-(benzenesulfonyloxy)phenyl]-5-oxo-3-pyrrolidinyl]methoxy]benzoic acid IUPAC Name: 4-[[1-[4-(benzenesulfonyloxy)phenyl]-5-oxopyrrolidin-3-yl]methoxy]benzoic acid Traditional Name: 4-[[1-(4-besyloxyphenyl)-5-keto-pyrrolidin-3-yl]methoxy]benzoic acid Formula: C24H21NO7S MolecularWeight: 467.49104

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC=C3)COC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1C(CN(C1=O)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC=C3)COC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H21NO7S/c26-23-14-17(16-31-20-10-6-18(7-11-20)24(27)28)15-25(23)19-8-12-21(13-9-19)32-33(29,30)22-4-2-1-3-5-22/h1-13,17H,14-16H2,(H,27,28)