N-[3-methoxy-4-(2-oxidanylidenepiperidin-1-yl)phenyl]-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[3-methoxy-4-(2-oxidanylidenepiperidin-1-yl)phenyl]-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-[3-methoxy-4-(2-oxo-1-piperidyl)phenyl]-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-[3-methoxy-4-(2-oxo-1-piperidinyl)phenyl]-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-[3-methoxy-4-(2-oxopiperidin-1-yl)phenyl]-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-[4-(2-ketopiperidino)-3-methoxy-phenyl]-2-methyl-5-nitro-benzenesulfonamide Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC(=C(C=C2)N3CCCCC3=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC(=C(C=C2)N3CCCCC3=O)OC

InChI

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