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

Systemtic Name: N-(3-cyanophenyl)-1-(5-cyanopyridin-1-ium-2-yl)piperidine-4-carboxamide Openeye Name: N-(3-cyanophenyl)-1-(5-cyanopyridin-1-ium-2-yl)piperidine-4-carboxamide CAS Name: N-(3-cyanophenyl)-1-(5-cyano-2-pyridin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: N-(3-cyanophenyl)-1-(5-cyanopyridin-1-ium-2-yl)piperidine-4-carboxamide Traditional Name: N-(3-cyanophenyl)-1-(5-cyanopyridin-1-ium-2-yl)isonipecotamide Formula: C19H18N5O+ MolecularWeight: 332.37912

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC(=C2)C#N)C3=[NH+]C=C(C=C3)C#N

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC(=C2)C#N)C3=[NH+]C=C(C=C3)C#N

InChI

InChI=1S/C19H17N5O/c20-11-14-2-1-3-17(10-14)23-19(25)16-6-8-24(9-7-16)18-5-4-15(12-21)13-22-18/h1-5,10,13,16H,6-9H2,(H,23,25)/p+1