3-nitro-4-(2-oxidanylidenepyrrolidin-1-yl)-N-propyl-benzenesulfonamide

Systemtic Name: 3-nitro-4-(2-oxidanylidenepyrrolidin-1-yl)-N-propyl-benzenesulfonamide Openeye Name: 3-nitro-4-(2-oxopyrrolidin-1-yl)-N-propyl-benzenesulfonamide CAS Name: 3-nitro-4-(2-oxo-1-pyrrolidinyl)-N-propylbenzenesulfonamide IUPAC Name: 3-nitro-4-(2-oxopyrrolidin-1-yl)-N-propylbenzenesulfonamide Traditional Name: 4-(2-ketopyrrolidino)-3-nitro-N-propyl-benzenesulfonamide Formula: C13H17N3O5S MolecularWeight: 327.35618

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=CC(=C(C=C1)N2CCCC2=O)[N+](=O)[O-]

Isomeric SMILES

CCCNS(=O)(=O)C1=CC(=C(C=C1)N2CCCC2=O)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O5S/c1-2-7-14-22(20,21)10-5-6-11(12(9-10)16(18)19)15-8-3-4-13(15)17/h5-6,9,14H,2-4,7-8H2,1H3