N-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyridine-4-carboxamide

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyridine-4-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)pyridine-4-carboxamide CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-pyridinecarboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)pyridine-4-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)isonicotinamide Formula: C18H22N3O+ MolecularWeight: 296.38678

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC=NC=C2)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC=NC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C18H21N3O/c22-18(16-6-10-19-11-7-16)20-17-8-12-21(13-9-17)14-15-4-2-1-3-5-15/h1-7,10-11,17H,8-9,12-14H2,(H,20,22)/p+1