N-methyl-4-[(2S)-2-methylpiperidin-1-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-methyl-4-[(2S)-2-methylpiperidin-1-yl]-3-nitro-benzenesulfonamide Openeye Name: N-methyl-4-[(2S)-2-methyl-1-piperidyl]-3-nitro-benzenesulfonamide CAS Name: N-methyl-4-[(2S)-2-methyl-1-piperidinyl]-3-nitrobenzenesulfonamide IUPAC Name: N-methyl-4-[(2S)-2-methylpiperidin-1-yl]-3-nitrobenzenesulfonamide Traditional Name: N-methyl-4-[(2S)-2-methylpiperidino]-3-nitro-benzenesulfonamide Formula: C13H19N3O4S MolecularWeight: 313.37266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=C(C=C(C=C2)S(=O)(=O)NC)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCCN1C2=C(C=C(C=C2)S(=O)(=O)NC)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O4S/c1-10-5-3-4-8-15(10)12-7-6-11(21(19,20)14-2)9-13(12)16(17)18/h6-7,9-10,14H,3-5,8H2,1-2H3/t10-/m0/s1