(3-iodanylphenyl) 4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonate

Systemtic Name: (3-iodanylphenyl) 4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonate Openeye Name: (3-iodophenyl) 4-(2-oxopyrrolidin-1-yl)benzenesulfonate CAS Name: 4-(2-oxo-1-pyrrolidinyl)benzenesulfonic acid (3-iodophenyl) ester IUPAC Name: (3-iodophenyl) 4-(2-oxopyrrolidin-1-yl)benzenesulfonate Traditional Name: 4-(2-ketopyrrolidino)benzenesulfonic acid (3-iodophenyl) ester Formula: C16H14INO4S MolecularWeight: 443.25613

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)OC3=CC(=CC=C3)I

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)OC3=CC(=CC=C3)I

InChI

InChI=1S/C16H14INO4S/c17-12-3-1-4-14(11-12)22-23(20,21)15-8-6-13(7-9-15)18-10-2-5-16(18)19/h1,3-4,6-9,11H,2,5,10H2