(6-fluoranyl-1H-benzimidazol-2-yl)methyl-methyl-[[2-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]azanium

Systemtic Name: (6-fluoranyl-1H-benzimidazol-2-yl)methyl-methyl-[[2-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]azanium Openeye Name: (6-fluoro-1H-benzimidazol-2-yl)methyl-[[2-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]-methyl-ammonium CAS Name: (6-fluoro-1H-benzimidazol-2-yl)methyl-[[2-[(2R)-2-hydroxy-3-(1-piperidin-1-iumyl)propoxy]phenyl]methyl]-methylammonium IUPAC Name: (6-fluoro-1H-benzimidazol-2-yl)methyl-[[2-[(2R)-2-hydroxy-3-piperidin-1-ium-1-ylpropoxy]phenyl]methyl]-methylazanium Traditional Name: (6-fluoro-1H-benzimidazol-2-yl)methyl-[2-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]benzyl]-methyl-ammonium Formula: C24H33FN4O2+2 MolecularWeight: 428.542823

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1OCC(C[NH+]2CCCCC2)O)CC3=NC4=C(N3)C=C(C=C4)F

Isomeric SMILES

C[NH+](CC1=CC=CC=C1OC[C@@H](C[NH+]2CCCCC2)O)CC3=NC4=C(N3)C=C(C=C4)F

InChI

InChI=1S/C24H31FN4O2/c1-28(16-24-26-21-10-9-19(25)13-22(21)27-24)14-18-7-3-4-8-23(18)31-17-20(30)15-29-11-5-2-6-12-29/h3-4,7-10,13,20,30H,2,5-6,11-12,14-17H2,1H3,(H,26,27)/p+2/t20-/m1/s1