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

Systemtic Name: [4-methoxy-3-[(2R)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propoxy]phenyl]methyl-[2-(3-methylpyridin-2-yl)ethyl]azanium Openeye Name: [3-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]-4-methoxy-phenyl]methyl-[2-(3-methyl-2-pyridyl)ethyl]ammonium CAS Name: [3-[(2R)-2-hydroxy-3-(1-pyrrolidin-1-iumyl)propoxy]-4-methoxyphenyl]methyl-[2-(3-methyl-2-pyridinyl)ethyl]ammonium IUPAC Name: [3-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-ylpropoxy]-4-methoxyphenyl]methyl-[2-(3-methylpyridin-2-yl)ethyl]azanium Traditional Name: [3-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]-4-methoxy-benzyl]-[2-(3-methyl-2-pyridyl)ethyl]ammonium Formula: C23H35N3O3+2 MolecularWeight: 401.5423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)CC[NH2+]CC2=CC(=C(C=C2)OC)OCC(C[NH+]3CCCC3)O

Isomeric SMILES

CC1=C(N=CC=C1)CC[NH2+]CC2=CC(=C(C=C2)OC)OC[C@@H](C[NH+]3CCCC3)O

InChI

InChI=1S/C23H33N3O3/c1-18-6-5-10-25-21(18)9-11-24-15-19-7-8-22(28-2)23(14-19)29-17-20(27)16-26-12-3-4-13-26/h5-8,10,14,20,24,27H,3-4,9,11-13,15-17H2,1-2H3/p+2/t20-/m1/s1