2,3-dimethyl-5-nitro-N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]benzenesulfonamide

Systemtic Name: 2,3-dimethyl-5-nitro-N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]benzenesulfonamide Openeye Name: 2,3-dimethyl-5-nitro-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzenesulfonamide CAS Name: 2,3-dimethyl-5-nitro-N-[[3-(2-oxo-1-pyrrolidinyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 2,3-dimethyl-5-nitro-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzenesulfonamide Traditional Name: N-[3-(2-ketopyrrolidino)benzyl]-2,3-dimethyl-5-nitro-benzenesulfonamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)NCC2=CC(=CC=C2)N3CCCC3=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)NCC2=CC(=CC=C2)N3CCCC3=O)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O5S/c1-13-9-17(22(24)25)11-18(14(13)2)28(26,27)20-12-15-5-3-6-16(10-15)21-8-4-7-19(21)23/h3,5-6,9-11,20H,4,7-8,12H2,1-2H3