(2-methoxy-5-nitro-phenyl) 4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonate

Systemtic Name: (2-methoxy-5-nitro-phenyl) 4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonate Openeye Name: (2-methoxy-5-nitro-phenyl) 4-(2-oxopyrrolidin-1-yl)benzenesulfonate CAS Name: 4-(2-oxo-1-pyrrolidinyl)benzenesulfonic acid (2-methoxy-5-nitrophenyl) ester IUPAC Name: (2-methoxy-5-nitrophenyl) 4-(2-oxopyrrolidin-1-yl)benzenesulfonate Traditional Name: 4-(2-ketopyrrolidino)benzenesulfonic acid (2-methoxy-5-nitro-phenyl) ester Formula: C17H16N2O7S MolecularWeight: 392.38314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])OS(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])OS(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C17H16N2O7S/c1-25-15-9-6-13(19(21)22)11-16(15)26-27(23,24)14-7-4-12(5-8-14)18-10-2-3-17(18)20/h4-9,11H,2-3,10H2,1H3