N-(4-methylphenyl)-2-(4-pyridin-3-ylcarbonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(4-methylphenyl)-2-(4-pyridin-3-ylcarbonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(p-tolyl)-2-[4-(pyridine-3-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-methylphenyl)-2-[4-[oxo(3-pyridinyl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-methylphenyl)-2-[4-(pyridine-3-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: 2-(4-nicotinoylpiperazin-1-ium-1-yl)-N-(p-tolyl)acetamide Formula: C19H23N4O2+ MolecularWeight: 339.41152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H22N4O2/c1-15-4-6-17(7-5-15)21-18(24)14-22-9-11-23(12-10-22)19(25)16-3-2-8-20-13-16/h2-8,13H,9-12,14H2,1H3,(H,21,24)/p+1