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

Systemtic Name: methyl-[[2-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]-(pyridin-3-ylmethyl)azanium Openeye Name: [2-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl-methyl-(3-pyridylmethyl)ammonium CAS Name: [2-[(2R)-2-hydroxy-3-(1-piperidin-1-iumyl)propoxy]phenyl]methyl-methyl-(3-pyridinylmethyl)ammonium IUPAC Name: [2-[(2R)-2-hydroxy-3-piperidin-1-ium-1-ylpropoxy]phenyl]methyl-methyl-(pyridin-3-ylmethyl)azanium Traditional Name: [2-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]benzyl]-methyl-(3-pyridylmethyl)ammonium Formula: C22H33N3O2+2 MolecularWeight: 371.51632

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CN=CC=C1)CC2=CC=CC=C2OCC(C[NH+]3CCCCC3)O

Isomeric SMILES

C[NH+](CC1=CN=CC=C1)CC2=CC=CC=C2OC[C@@H](C[NH+]3CCCCC3)O

InChI

InChI=1S/C22H31N3O2/c1-24(15-19-8-7-11-23-14-19)16-20-9-3-4-10-22(20)27-18-21(26)17-25-12-5-2-6-13-25/h3-4,7-11,14,21,26H,2,5-6,12-13,15-18H2,1H3/p+2/t21-/m1/s1