4-[[2-oxidanylidene-1-[4-(phenylsulfonyloxy)phenyl]pyrrolidin-3-yl]methoxy]benzoic acid

Systemtic Name: 4-[[2-oxidanylidene-1-[4-(phenylsulfonyloxy)phenyl]pyrrolidin-3-yl]methoxy]benzoic acid Openeye Name: 4-[[1-[4-(benzenesulfonyloxy)phenyl]-2-oxo-pyrrolidin-3-yl]methoxy]benzoic acid CAS Name: 4-[[1-[4-(benzenesulfonyloxy)phenyl]-2-oxo-3-pyrrolidinyl]methoxy]benzoic acid IUPAC Name: 4-[[1-[4-(benzenesulfonyloxy)phenyl]-2-oxopyrrolidin-3-yl]methoxy]benzoic acid Traditional Name: 4-[[1-(4-besyloxyphenyl)-2-keto-pyrrolidin-3-yl]methoxy]benzoic acid Formula: C24H21NO7S MolecularWeight: 467.49104

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1COC2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)OS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(C(=O)C1COC2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)OS(=O)(=O)C4=CC=CC=C4

InChI

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