N-(1-methylpiperidin-1-ium-4-yl)pyridine-4-carboxamide

Systemtic Name: N-(1-methylpiperidin-1-ium-4-yl)pyridine-4-carboxamide Openeye Name: N-(1-methylpiperidin-1-ium-4-yl)pyridine-4-carboxamide CAS Name: N-(1-methyl-4-piperidin-1-iumyl)-4-pyridinecarboxamide IUPAC Name: N-(1-methylpiperidin-1-ium-4-yl)pyridine-4-carboxamide Traditional Name: N-(1-methylpiperidin-1-ium-4-yl)isonicotinamide Formula: C12H18N3O+ MolecularWeight: 220.29082

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC(=O)C2=CC=NC=C2

Isomeric SMILES

C[NH+]1CCC(CC1)NC(=O)C2=CC=NC=C2

InChI

InChI=1S/C12H17N3O/c1-15-8-4-11(5-9-15)14-12(16)10-2-6-13-7-3-10/h2-3,6-7,11H,4-5,8-9H2,1H3,(H,14,16)/p+1