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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC(=C2)CN3CCCC3=O

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC(=C2)CN3CCCC3=O

InChI

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