(3-ethoxy-2-oxidanyl-phenyl)methyl-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-methyl-azanium

Systemtic Name: (3-ethoxy-2-oxidanyl-phenyl)methyl-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-methyl-azanium Openeye Name: (3-ethoxy-2-hydroxy-phenyl)methyl-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-methyl-ammonium CAS Name: (3-ethoxy-2-hydroxyphenyl)methyl-[[1-[2-(4-methoxyphenyl)ethyl]-4-piperidin-1-iumyl]methyl]-methylammonium IUPAC Name: (3-ethoxy-2-hydroxyphenyl)methyl-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-methylazanium Traditional Name: (3-ethoxy-2-hydroxy-benzyl)-[[1-[2-(4-methoxyphenyl)ethyl]piperidin-1-ium-4-yl]methyl]-methyl-ammonium Formula: C25H38N2O3+2 MolecularWeight: 414.58082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)C[NH+](C)CC2CC[NH+](CC2)CCC3=CC=C(C=C3)OC

Isomeric SMILES

CCOC1=CC=CC(=C1O)C[NH+](C)CC2CC[NH+](CC2)CCC3=CC=C(C=C3)OC

InChI

InChI=1S/C25H36N2O3/c1-4-30-24-7-5-6-22(25(24)28)19-26(2)18-21-13-16-27(17-14-21)15-12-20-8-10-23(29-3)11-9-20/h5-11,21,28H,4,12-19H2,1-3H3/p+2