(2-oxidanylidene-1-pyridin-2-yl-pyrrolidin-3-yl) 3-nitrobenzenesulfonate

Systemtic Name: (2-oxidanylidene-1-pyridin-2-yl-pyrrolidin-3-yl) 3-nitrobenzenesulfonate Openeye Name: [2-oxo-1-(2-pyridyl)pyrrolidin-3-yl] 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid [2-oxo-1-(2-pyridinyl)-3-pyrrolidinyl] ester IUPAC Name: (2-oxo-1-pyridin-2-ylpyrrolidin-3-yl) 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid [2-keto-1-(2-pyridyl)pyrrolidin-3-yl] ester Formula: C15H13N3O6S MolecularWeight: 363.34522

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1OS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=CC=CC=N3

Isomeric SMILES

C1CN(C(=O)C1OS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])C3=CC=CC=N3

InChI

InChI=1S/C15H13N3O6S/c19-15-13(7-9-17(15)14-6-1-2-8-16-14)24-25(22,23)12-5-3-4-11(10-12)18(20)21/h1-6,8,10,13H,7,9H2