4-methyl-3-nitro-N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]benzenesulfonamide

Systemtic Name: 4-methyl-3-nitro-N-[[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]benzenesulfonamide Openeye Name: 4-methyl-3-nitro-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzenesulfonamide CAS Name: 4-methyl-3-nitro-N-[[3-(2-oxo-1-pyrrolidinyl)phenyl]methyl]benzenesulfonamide IUPAC Name: 4-methyl-3-nitro-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzenesulfonamide Traditional Name: N-[3-(2-ketopyrrolidino)benzyl]-4-methyl-3-nitro-benzenesulfonamide Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC(=CC=C2)N3CCCC3=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC(=CC=C2)N3CCCC3=O)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c1-13-7-8-16(11-17(13)21(23)24)27(25,26)19-12-14-4-2-5-15(10-14)20-9-3-6-18(20)22/h2,4-5,7-8,10-11,19H,3,6,9,12H2,1H3