N-methyl-3,5-dinitro-4-piperidin-1-yl-benzenesulfonamide

Systemtic Name: N-methyl-3,5-dinitro-4-piperidin-1-yl-benzenesulfonamide Openeye Name: N-methyl-3,5-dinitro-4-(1-piperidyl)benzenesulfonamide CAS Name: N-methyl-3,5-dinitro-4-(1-piperidinyl)benzenesulfonamide IUPAC Name: N-methyl-3,5-dinitro-4-piperidin-1-ylbenzenesulfonamide Traditional Name: N-methyl-3,5-dinitro-4-piperidino-benzenesulfonamide Formula: C12H16N4O6S MolecularWeight: 344.34364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])N2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C(=C1)[N+](=O)[O-])N2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O6S/c1-13-23(21,22)9-7-10(15(17)18)12(11(8-9)16(19)20)14-5-3-2-4-6-14/h7-8,13H,2-6H2,1H3