N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]pyridine-4-carboxamide

Systemtic Name: N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]pyridine-4-carboxamide Openeye Name: N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]pyridine-4-carboxamide CAS Name: N-[4-(1-piperidin-1-iumylmethyl)phenyl]-4-pyridinecarboxamide IUPAC Name: N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]pyridine-4-carboxamide Traditional Name: N-[4-(piperidin-1-ium-1-ylmethyl)phenyl]isonicotinamide Formula: C18H22N3O+ MolecularWeight: 296.38678

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)NC(=O)C3=CC=NC=C3

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)NC(=O)C3=CC=NC=C3

InChI

InChI=1S/C18H21N3O/c22-18(16-8-10-19-11-9-16)20-17-6-4-15(5-7-17)14-21-12-2-1-3-13-21/h4-11H,1-3,12-14H2,(H,20,22)/p+1