[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 2-bromanylbenzenesulfonate

Systemtic Name: [4-(2-oxidanylidenepyrrolidin-1-yl)phenyl] 2-bromanylbenzenesulfonate Openeye Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 2-bromobenzenesulfonate CAS Name: 2-bromobenzenesulfonic acid [4-(2-oxo-1-pyrrolidinyl)phenyl] ester IUPAC Name: [4-(2-oxopyrrolidin-1-yl)phenyl] 2-bromobenzenesulfonate Traditional Name: 2-bromobenzenesulfonic acid [4-(2-ketopyrrolidino)phenyl] ester Formula: C16H14BrNO4S MolecularWeight: 396.25566

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC=C3Br

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C16H14BrNO4S/c17-14-4-1-2-5-15(14)23(20,21)22-13-9-7-12(8-10-13)18-11-3-6-16(18)19/h1-2,4-5,7-10H,3,6,11H2