N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methylpropyl)pyridine-4-carboxamide

Systemtic Name: N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methylpropyl)pyridine-4-carboxamide Openeye Name: N-isobutyl-N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]pyridine-4-carboxamide CAS Name: N-[[1-[(2-methoxyphenyl)methyl]-4-piperidin-1-iumyl]methyl]-N-(2-methylpropyl)-4-pyridinecarboxamide IUPAC Name: N-[[1-[(2-methoxyphenyl)methyl]piperidin-1-ium-4-yl]methyl]-N-(2-methylpropyl)pyridine-4-carboxamide Traditional Name: N-isobutyl-N-[(1-o-anisylpiperidin-1-ium-4-yl)methyl]isonicotinamide Formula: C24H34N3O2+ MolecularWeight: 396.54566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1CC[NH+](CC1)CC2=CC=CC=C2OC)C(=O)C3=CC=NC=C3

Isomeric SMILES

CC(C)CN(CC1CC[NH+](CC1)CC2=CC=CC=C2OC)C(=O)C3=CC=NC=C3

InChI

InChI=1S/C24H33N3O2/c1-19(2)16-27(24(28)21-8-12-25-13-9-21)17-20-10-14-26(15-11-20)18-22-6-4-5-7-23(22)29-3/h4-9,12-13,19-20H,10-11,14-18H2,1-3H3/p+1