4-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]benzamide

Systemtic Name: 4-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]benzamide Openeye Name: 4-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]benzamide CAS Name: 4-methyl-N-[2-(4-methyl-1-piperazin-4-iumyl)-3-pyridin-1-iumyl]benzamide IUPAC Name: 4-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]benzamide Traditional Name: 4-methyl-N-[2-(4-methylpiperazin-4-ium-1-yl)pyridin-1-ium-3-yl]benzamide Formula: C18H24N4O+2 MolecularWeight: 312.40936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=C([NH+]=CC=C2)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=C([NH+]=CC=C2)N3CC[NH+](CC3)C

InChI

InChI=1S/C18H22N4O/c1-14-5-7-15(8-6-14)18(23)20-16-4-3-9-19-17(16)22-12-10-21(2)11-13-22/h3-9H,10-13H2,1-2H3,(H,20,23)/p+2