N-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyridine-3-carboxamide

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyridine-3-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)pyridine-3-carboxamide CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-pyridinecarboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)pyridine-3-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)nicotinamide Formula: C18H22N3O+ MolecularWeight: 296.38678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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