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

Systemtic Name: 1-(5-cyanopyridin-1-ium-2-yl)-N-(4-ethoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-(5-cyanopyridin-1-ium-2-yl)-N-(4-ethoxyphenyl)piperidine-4-carboxamide CAS Name: 1-(5-cyano-2-pyridin-1-iumyl)-N-(4-ethoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-(5-cyanopyridin-1-ium-2-yl)-N-(4-ethoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-(5-cyanopyridin-1-ium-2-yl)-N-p-phenetyl-isonipecotamide Formula: C20H23N4O2+ MolecularWeight: 351.42222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=[NH+]C=C(C=C3)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=[NH+]C=C(C=C3)C#N

InChI

InChI=1S/C20H22N4O2/c1-2-26-18-6-4-17(5-7-18)23-20(25)16-9-11-24(12-10-16)19-8-3-15(13-21)14-22-19/h3-8,14,16H,2,9-12H2,1H3,(H,23,25)/p+1