2-[4-(3-cyanopyridin-2-yl)piperazin-1-ium-1-yl]-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[4-(3-cyanopyridin-2-yl)piperazin-1-ium-1-yl]-N-(4-methylphenyl)ethanamide Openeye Name: 2-[4-(3-cyano-2-pyridyl)piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide CAS Name: 2-[4-(3-cyano-2-pyridinyl)-1-piperazin-1-iumyl]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[4-(3-cyanopyridin-2-yl)piperazin-1-ium-1-yl]-N-(4-methylphenyl)acetamide Traditional Name: 2-[4-(3-cyano-2-pyridyl)piperazin-1-ium-1-yl]-N-(p-tolyl)acetamide Formula: C19H22N5O+ MolecularWeight: 336.41088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C3=C(C=CC=N3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C3=C(C=CC=N3)C#N

InChI

InChI=1S/C19H21N5O/c1-15-4-6-17(7-5-15)22-18(25)14-23-9-11-24(12-10-23)19-16(13-20)3-2-8-21-19/h2-8H,9-12,14H2,1H3,(H,22,25)/p+1