1-(5-cyanopyridin-1-ium-2-yl)-N-(3-methoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-(5-cyanopyridin-1-ium-2-yl)-N-(3-methoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-(5-cyanopyridin-1-ium-2-yl)-N-(3-methoxyphenyl)piperidine-4-carboxamide CAS Name: 1-(5-cyano-2-pyridin-1-iumyl)-N-(3-methoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-cyanopyridin-1-ium-2-yl)-N-(3-methoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-(5-cyanopyridin-1-ium-2-yl)-N-(3-methoxyphenyl)isonipecotamide Formula: C19H21N4O2+ MolecularWeight: 337.39564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)C2CCN(CC2)C3=[NH+]C=C(C=C3)C#N

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)C2CCN(CC2)C3=[NH+]C=C(C=C3)C#N

InChI

InChI=1S/C19H20N4O2/c1-25-17-4-2-3-16(11-17)22-19(24)15-7-9-23(10-8-15)18-6-5-14(12-20)13-21-18/h2-6,11,13,15H,7-10H2,1H3,(H,22,24)/p+1