N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]pyridine-4-carboxamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]pyridine-4-carboxamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]pyridine-4-carboxamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methyl-4-piperidin-1-iumyl)methyl]-4-pyridinecarboxamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]pyridine-4-carboxamide Traditional Name: N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]isonicotinamide Formula: C22H30N3O2+ MolecularWeight: 368.4925

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O2/c1-24-14-9-19(10-15-24)17-25(22(26)20-7-12-23-13-8-20)16-11-18-3-5-21(27-2)6-4-18/h3-8,12-13,19H,9-11,14-17H2,1-2H3/p+1