methyl-[(3-methylpyridin-4-yl)methyl]-[[4-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]azanium

Systemtic Name: methyl-[(3-methylpyridin-4-yl)methyl]-[[4-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]azanium Openeye Name: [4-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl-methyl-[(3-methyl-4-pyridyl)methyl]ammonium CAS Name: [4-[(2R)-2-hydroxy-3-(1-piperidin-1-iumyl)propoxy]phenyl]methyl-methyl-[(3-methyl-4-pyridinyl)methyl]ammonium IUPAC Name: [4-[(2R)-2-hydroxy-3-piperidin-1-ium-1-ylpropoxy]phenyl]methyl-methyl-[(3-methylpyridin-4-yl)methyl]azanium Traditional Name: [4-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]benzyl]-methyl-[(3-methyl-4-pyridyl)methyl]ammonium Formula: C23H35N3O2+2 MolecularWeight: 385.5429

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)C[NH+](C)CC2=CC=C(C=C2)OCC(C[NH+]3CCCCC3)O

Isomeric SMILES

CC1=C(C=CN=C1)C[NH+](C)CC2=CC=C(C=C2)OC[C@@H](C[NH+]3CCCCC3)O

InChI

InChI=1S/C23H33N3O2/c1-19-14-24-11-10-21(19)16-25(2)15-20-6-8-23(9-7-20)28-18-22(27)17-26-12-4-3-5-13-26/h6-11,14,22,27H,3-5,12-13,15-18H2,1-2H3/p+2/t22-/m1/s1