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

Systemtic Name: [4-methoxy-2-[(2R)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propoxy]phenyl]methyl-methyl-[2-(4-methylphenoxy)ethyl]azanium Openeye Name: [2-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]-4-methoxy-phenyl]methyl-methyl-[2-(4-methylphenoxy)ethyl]ammonium CAS Name: [2-[(2R)-2-hydroxy-3-(1-pyrrolidin-1-iumyl)propoxy]-4-methoxyphenyl]methyl-methyl-[2-(4-methylphenoxy)ethyl]ammonium IUPAC Name: [2-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-ylpropoxy]-4-methoxyphenyl]methyl-methyl-[2-(4-methylphenoxy)ethyl]azanium Traditional Name: [2-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]-4-methoxy-benzyl]-methyl-[2-(4-methylphenoxy)ethyl]ammonium Formula: C25H38N2O4+2 MolecularWeight: 430.58022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H36N2O4/c1-20-6-9-23(10-7-20)30-15-14-26(2)17-21-8-11-24(29-3)16-25(21)31-19-22(28)18-27-12-4-5-13-27/h6-11,16,22,28H,4-5,12-15,17-19H2,1-3H3/p+2/t22-/m1/s1