N-[[(2R)-oxolan-2-yl]methyl]-3-[1-[(1-pyridin-2-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-[[(2R)-oxolan-2-yl]methyl]-3-[1-[(1-pyridin-2-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]propanamide Openeye Name: 3-[1-[[1-(2-pyridyl)pyrrol-2-yl]methyl]piperidin-1-ium-4-yl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]propanamide CAS Name: N-[[(2R)-2-oxolanyl]methyl]-3-[1-[[1-(2-pyridinyl)-2-pyrrolyl]methyl]-4-piperidin-1-iumyl]propanamide IUPAC Name: N-[[(2R)-oxolan-2-yl]methyl]-3-[1-[(1-pyridin-2-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]propanamide Traditional Name: 3-[1-[[1-(2-pyridyl)pyrrol-2-yl]methyl]piperidin-1-ium-4-yl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]propionamide Formula: C23H33N4O2+ MolecularWeight: 397.53372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)CCC2CC[NH+](CC2)CC3=CC=CN3C4=CC=CC=N4

Isomeric SMILES

C1C[C@@H](OC1)CNC(=O)CCC2CC[NH+](CC2)CC3=CC=CN3C4=CC=CC=N4

InChI

InChI=1S/C23H32N4O2/c28-23(25-17-21-6-4-16-29-21)9-8-19-10-14-26(15-11-19)18-20-5-3-13-27(20)22-7-1-2-12-24-22/h1-3,5,7,12-13,19,21H,4,6,8-11,14-18H2,(H,25,28)/p+1/t21-/m1/s1