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

Systemtic Name: 2-methyl-N-[3-methyl-4-(2-oxidanylidenepiperidin-1-yl)phenyl]-5-nitro-benzenesulfonamide Openeye Name: 2-methyl-N-[3-methyl-4-(2-oxo-1-piperidyl)phenyl]-5-nitro-benzenesulfonamide CAS Name: 2-methyl-N-[3-methyl-4-(2-oxo-1-piperidinyl)phenyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-methyl-N-[3-methyl-4-(2-oxopiperidin-1-yl)phenyl]-5-nitrobenzenesulfonamide Traditional Name: N-[4-(2-ketopiperidino)-3-methyl-phenyl]-2-methyl-5-nitro-benzenesulfonamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O5S/c1-13-6-8-16(22(24)25)12-18(13)28(26,27)20-15-7-9-17(14(2)11-15)21-10-4-3-5-19(21)23/h6-9,11-12,20H,3-5,10H2,1-2H3