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

Systemtic Name: 2,3-dimethyl-5-nitro-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzenesulfonamide Openeye Name: 2,3-dimethyl-5-nitro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzenesulfonamide CAS Name: 2,3-dimethyl-5-nitro-N-[3-(2-oxo-1-pyrrolidinyl)phenyl]benzenesulfonamide IUPAC Name: 2,3-dimethyl-5-nitro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzenesulfonamide Traditional Name: N-[3-(2-ketopyrrolidino)phenyl]-2,3-dimethyl-5-nitro-benzenesulfonamide Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)NC2=CC=CC(=C2)N3CCCC3=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)NC2=CC=CC(=C2)N3CCCC3=O)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c1-12-9-16(21(23)24)11-17(13(12)2)27(25,26)19-14-5-3-6-15(10-14)20-8-4-7-18(20)22/h3,5-6,9-11,19H,4,7-8H2,1-2H3