N-[[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)pyridine-4-carboxamide

Systemtic Name: N-[[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)pyridine-4-carboxamide Openeye Name: N-[[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)pyridine-4-carboxamide CAS Name: N-[[1-[(2-fluorophenyl)methyl]-4-piperidin-1-iumyl]methyl]-N-(2-methoxyethyl)-4-pyridinecarboxamide IUPAC Name: N-[[1-[(2-fluorophenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)pyridine-4-carboxamide Traditional Name: N-[[1-(2-fluorobenzyl)piperidin-1-ium-4-yl]methyl]-N-(2-methoxyethyl)isonicotinamide Formula: C22H29FN3O2+ MolecularWeight: 386.482963

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1CC[NH+](CC1)CC2=CC=CC=C2F)C(=O)C3=CC=NC=C3

Isomeric SMILES

COCCN(CC1CC[NH+](CC1)CC2=CC=CC=C2F)C(=O)C3=CC=NC=C3

InChI

InChI=1S/C22H28FN3O2/c1-28-15-14-26(22(27)19-6-10-24-11-7-19)16-18-8-12-25(13-9-18)17-20-4-2-3-5-21(20)23/h2-7,10-11,18H,8-9,12-17H2,1H3/p+1