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

Systemtic Name: (2-methoxy-2-methyl-propyl)-[[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-(2-methoxy-2-methyl-propyl)ammonium CAS Name: [2-[(2R)-2-hydroxy-3-(1-piperidin-1-iumyl)propoxy]phenyl]methyl-(2-methoxy-2-methylpropyl)ammonium IUPAC Name: [2-[(2R)-2-hydroxy-3-piperidin-1-ium-1-ylpropoxy]phenyl]methyl-(2-methoxy-2-methylpropyl)azanium Traditional Name: [2-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]benzyl]-(2-methoxy-2-methyl-propyl)ammonium Formula: C20H36N2O3+2 MolecularWeight: 352.51144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[NH2+]CC1=CC=CC=C1OCC(C[NH+]2CCCCC2)O)OC

Isomeric SMILES

CC(C)(C[NH2+]CC1=CC=CC=C1OC[C@@H](C[NH+]2CCCCC2)O)OC

InChI

InChI=1S/C20H34N2O3/c1-20(2,24-3)16-21-13-17-9-5-6-10-19(17)25-15-18(23)14-22-11-7-4-8-12-22/h5-6,9-10,18,21,23H,4,7-8,11-16H2,1-3H3/p+2/t18-/m1/s1