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

Systemtic Name: 3-nitro-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonate Openeye Name: 3-nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonate CAS Name: 3-nitro-4-(2-oxo-1-pyrrolidinyl)benzenesulfonate IUPAC Name: 3-nitro-4-(2-oxopyrrolidin-1-yl)benzenesulfonate Traditional Name: 4-(2-ketopyrrolidino)-3-nitro-besylate Formula: C10H9N2O6S- MolecularWeight: 285.25326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)C2=C(C=C(C=C2)S(=O)(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H10N2O6S/c13-10-2-1-5-11(10)8-4-3-7(19(16,17)18)6-9(8)12(14)15/h3-4,6H,1-2,5H2,(H,16,17,18)/p-1