N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-(1H-pyrazol-4-yl)propanamide

Systemtic Name: N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-(1H-pyrazol-4-yl)propanamide Openeye Name: N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-(1H-pyrazol-4-yl)propanamide CAS Name: N-[[1-[2-(2-methoxyphenyl)ethyl]-4-piperidin-1-iumyl]methyl]-N-methyl-3-(1H-pyrazol-4-yl)propanamide IUPAC Name: N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-(1H-pyrazol-4-yl)propanamide Traditional Name: N-[[1-[2-(2-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-N-methyl-3-(1H-pyrazol-4-yl)propionamide Formula: C22H33N4O2+ MolecularWeight: 385.52302

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1CC[NH+](CC1)CCC2=CC=CC=C2OC)C(=O)CCC3=CNN=C3

Isomeric SMILES

CN(CC1CC[NH+](CC1)CCC2=CC=CC=C2OC)C(=O)CCC3=CNN=C3

InChI

InChI=1S/C22H32N4O2/c1-25(22(27)8-7-19-15-23-24-16-19)17-18-9-12-26(13-10-18)14-11-20-5-3-4-6-21(20)28-2/h3-6,15-16,18H,7-14,17H2,1-2H3,(H,23,24)/p+1