N-(4-methylphenyl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide

Systemtic Name: N-(4-methylphenyl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide Openeye Name: N-(p-tolyl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide CAS Name: N-(4-methylphenyl)-4-(2-pyridin-1-iumyl)-1-piperazinecarboxamide IUPAC Name: N-(4-methylphenyl)-4-pyridin-1-ium-2-ylpiperazine-1-carboxamide Traditional Name: N-(p-tolyl)-4-pyridin-1-ium-2-yl-piperazine-1-carboxamide Formula: C17H21N4O+ MolecularWeight: 297.37484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C17H20N4O/c1-14-5-7-15(8-6-14)19-17(22)21-12-10-20(11-13-21)16-4-2-3-9-18-16/h2-9H,10-13H2,1H3,(H,19,22)/p+1