4-[2-(4-methylpiperazin-4-ium-1-yl)-5-nitro-phenyl]sulfonylmorpholine

Systemtic Name: 4-[2-(4-methylpiperazin-4-ium-1-yl)-5-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[2-(4-methylpiperazin-4-ium-1-yl)-5-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[2-(4-methyl-1-piperazin-4-iumyl)-5-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[2-(4-methylpiperazin-4-ium-1-yl)-5-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[2-(4-methylpiperazin-4-ium-1-yl)-5-nitro-phenyl]sulfonylmorpholine Formula: C15H23N4O5S+ MolecularWeight: 371.43192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C15H22N4O5S/c1-16-4-6-17(7-5-16)14-3-2-13(19(20)21)12-15(14)25(22,23)18-8-10-24-11-9-18/h2-3,12H,4-11H2,1H3/p+1