4-methoxy-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-nitro-benzamide

Systemtic Name: 4-methoxy-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-nitro-benzamide Openeye Name: 4-methoxy-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-nitro-benzamide CAS Name: 4-methoxy-N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-methoxy-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-nitrobenzamide Traditional Name: 4-methoxy-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-nitro-benzamide Formula: C19H23N4O4+ MolecularWeight: 371.41032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4/c1-21-9-11-22(12-10-21)16-6-4-3-5-15(16)20-19(24)14-7-8-18(27-2)17(13-14)23(25)26/h3-8,13H,9-12H2,1-2H3,(H,20,24)/p+1