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

Systemtic Name: 2-(furan-2-yl)ethyl-[[4-methoxy-3-[(2R)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propoxy]phenyl]methyl]azanium Openeye Name: 2-(2-furyl)ethyl-[[3-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]-4-methoxy-phenyl]methyl]ammonium CAS Name: 2-(2-furanyl)ethyl-[[3-[(2R)-2-hydroxy-3-(1-pyrrolidin-1-iumyl)propoxy]-4-methoxyphenyl]methyl]ammonium IUPAC Name: 2-(furan-2-yl)ethyl-[[3-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-ylpropoxy]-4-methoxyphenyl]methyl]azanium Traditional Name: 2-(2-furyl)ethyl-[3-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]-4-methoxy-benzyl]ammonium Formula: C21H32N2O4+2 MolecularWeight: 376.48978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH2+]CCC2=CC=CO2)OCC(C[NH+]3CCCC3)O

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH2+]CCC2=CC=CO2)OC[C@@H](C[NH+]3CCCC3)O

InChI

InChI=1S/C21H30N2O4/c1-25-20-7-6-17(14-22-9-8-19-5-4-12-26-19)13-21(20)27-16-18(24)15-23-10-2-3-11-23/h4-7,12-13,18,22,24H,2-3,8-11,14-16H2,1H3/p+2/t18-/m1/s1