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

Systemtic Name: [3-methoxy-4-[(2R)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propoxy]phenyl]methyl-[2-(4-methylphenyl)ethyl]azanium Openeye Name: [4-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]-3-methoxy-phenyl]methyl-[2-(p-tolyl)ethyl]ammonium CAS Name: [4-[(2R)-2-hydroxy-3-(1-pyrrolidin-1-iumyl)propoxy]-3-methoxyphenyl]methyl-[2-(4-methylphenyl)ethyl]ammonium IUPAC Name: [4-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-ylpropoxy]-3-methoxyphenyl]methyl-[2-(4-methylphenyl)ethyl]azanium Traditional Name: [4-[(2R)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propoxy]-3-methoxy-benzyl]-[2-(p-tolyl)ethyl]ammonium Formula: C24H36N2O3+2 MolecularWeight: 400.55424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H34N2O3/c1-19-5-7-20(8-6-19)11-12-25-16-21-9-10-23(24(15-21)28-2)29-18-22(27)17-26-13-3-4-14-26/h5-10,15,22,25,27H,3-4,11-14,16-18H2,1-2H3/p+2/t22-/m1/s1