(8-methoxyquinolin-5-yl)methyl-methyl-[[2-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]azanium

Systemtic Name: (8-methoxyquinolin-5-yl)methyl-methyl-[[2-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]azanium Openeye Name: [2-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl-[(8-methoxy-5-quinolyl)methyl]-methyl-ammonium CAS Name: [2-[(2R)-2-hydroxy-3-(1-piperidin-1-iumyl)propoxy]phenyl]methyl-[(8-methoxy-5-quinolinyl)methyl]-methylammonium IUPAC Name: [2-[(2R)-2-hydroxy-3-piperidin-1-ium-1-ylpropoxy]phenyl]methyl-[(8-methoxyquinolin-5-yl)methyl]-methylazanium Traditional Name: [2-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]benzyl]-[(8-methoxy-5-quinolyl)methyl]-methyl-ammonium Formula: C27H37N3O3+2 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C2C=CC=NC2=C(C=C1)OC)CC3=CC=CC=C3OCC(C[NH+]4CCCCC4)O

Isomeric SMILES

C[NH+](CC1=C2C=CC=NC2=C(C=C1)OC)CC3=CC=CC=C3OC[C@@H](C[NH+]4CCCCC4)O

InChI

InChI=1S/C27H35N3O3/c1-29(17-21-12-13-26(32-2)27-24(21)10-8-14-28-27)18-22-9-4-5-11-25(22)33-20-23(31)19-30-15-6-3-7-16-30/h4-5,8-14,23,31H,3,6-7,15-20H2,1-2H3/p+2/t23-/m1/s1