2-(1H-benzimidazol-2-yl)ethyl-[[2-[(2S)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]azanium

Systemtic Name: 2-(1H-benzimidazol-2-yl)ethyl-[[2-[(2S)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]azanium Openeye Name: 2-(1H-benzimidazol-2-yl)ethyl-[[2-[(2S)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]ammonium CAS Name: 2-(1H-benzimidazol-2-yl)ethyl-[[2-[(2S)-2-hydroxy-3-(1-piperidin-1-iumyl)propoxy]phenyl]methyl]ammonium IUPAC Name: 2-(1H-benzimidazol-2-yl)ethyl-[[2-[(2S)-2-hydroxy-3-piperidin-1-ium-1-ylpropoxy]phenyl]methyl]azanium Traditional Name: 2-(1H-benzimidazol-2-yl)ethyl-[2-[(2S)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]benzyl]ammonium Formula: C24H34N4O2+2 MolecularWeight: 410.55236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(COC2=CC=CC=C2C[NH2+]CCC3=NC4=CC=CC=C4N3)O

Isomeric SMILES

C1CC[NH+](CC1)C[C@@H](COC2=CC=CC=C2C[NH2+]CCC3=NC4=CC=CC=C4N3)O

InChI

InChI=1S/C24H32N4O2/c29-20(17-28-14-6-1-7-15-28)18-30-23-11-5-2-8-19(23)16-25-13-12-24-26-21-9-3-4-10-22(21)27-24/h2-5,8-11,20,25,29H,1,6-7,12-18H2,(H,26,27)/p+2/t20-/m0/s1