N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2,3-dimethyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[3-methoxy-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2,3-dimethyl-5-nitro-benzenesulfonamide Openeye Name: N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-2,3-dimethyl-5-nitro-benzenesulfonamide CAS Name: N-[3-methoxy-4-(2-oxo-1-pyrrolidinyl)phenyl]-2,3-dimethyl-5-nitrobenzenesulfonamide IUPAC Name: N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]-2,3-dimethyl-5-nitrobenzenesulfonamide Traditional Name: N-[4-(2-ketopyrrolidino)-3-methoxy-phenyl]-2,3-dimethyl-5-nitro-benzenesulfonamide Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O6S/c1-12-9-15(22(24)25)11-18(13(12)2)29(26,27)20-14-6-7-16(17(10-14)28-3)21-8-4-5-19(21)23/h6-7,9-11,20H,4-5,8H2,1-3H3