N-[4-[2-(1-methylpiperidin-1-ium-4-yl)ethyl]phenyl]pyridine-3-carboxamide

Systemtic Name: N-[4-[2-(1-methylpiperidin-1-ium-4-yl)ethyl]phenyl]pyridine-3-carboxamide Openeye Name: N-[4-[2-(1-methylpiperidin-1-ium-4-yl)ethyl]phenyl]pyridine-3-carboxamide CAS Name: N-[4-[2-(1-methyl-4-piperidin-1-iumyl)ethyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-[2-(1-methylpiperidin-1-ium-4-yl)ethyl]phenyl]pyridine-3-carboxamide Traditional Name: N-[4-[2-(1-methylpiperidin-1-ium-4-yl)ethyl]phenyl]nicotinamide Formula: C20H26N3O+ MolecularWeight: 324.43994

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)CCC2=CC=C(C=C2)NC(=O)C3=CN=CC=C3

Isomeric SMILES

C[NH+]1CCC(CC1)CCC2=CC=C(C=C2)NC(=O)C3=CN=CC=C3

InChI

InChI=1S/C20H25N3O/c1-23-13-10-17(11-14-23)5-4-16-6-8-19(9-7-16)22-20(24)18-3-2-12-21-15-18/h2-3,6-9,12,15,17H,4-5,10-11,13-14H2,1H3,(H,22,24)/p+1