dioxidanium; bis(oxidanyl)-oxidanylidene-azanium; lanthanum; 2-[3-[[4-[[1-(2-oxidanidyl-2-oxidanyl-ethyl)pyridin-1-ium-3-yl]methoxy]phenoxy]methyl]pyridin-1-ium-1-yl]-1-oxidanyl-ethanolate; dihydroxide; hydrate

Systemtic Name: dioxidanium; bis(oxidanyl)-oxidanylidene-azanium; lanthanum; 2-[3-[[4-[[1-(2-oxidanidyl-2-oxidanyl-ethyl)pyridin-1-ium-3-yl]methoxy]phenoxy]methyl]pyridin-1-ium-1-yl]-1-oxidanyl-ethanolate; dihydroxide; hydrate Openeye Name: dioxonium; dihydroxy(oxo)ammonium; 1-hydroxy-2-[3-[[4-[[1-(2-hydroxy-2-oxido-ethyl)pyridin-1-ium-3-yl]methoxy]phenoxy]methyl]pyridin-1-ium-1-yl]ethanolate; lanthanum; dihydroxide; hydrate CAS Name: dioxonium; dihydroxy(oxo)ammonium; 1-hydroxy-2-[3-[[4-[[1-(2-hydroxy-2-oxidoethyl)-3-pyridin-1-iumyl]methoxy]phenoxy]methyl]-1-pyridin-1-iumyl]ethanolate; lanthanum; dihydroxide; hydrate IUPAC Name: dioxidanium; dihydroxy(oxo)azanium; 1-hydroxy-2-[3-[[4-[[1-(2-hydroxy-2-oxidoethyl)pyridin-1-ium-3-yl]methoxy]phenoxy]methyl]pyridin-1-ium-1-yl]ethanolate; lanthanum; dihydroxide; hydrate Traditional Name: dioxonium; dihydroxy(keto)ammonium; 1-hydroxy-2-[3-[[4-[[1-(2-hydroxy-2-oxido-ethyl)pyridin-1-ium-3-yl]methoxy]phenoxy]methyl]pyridin-1-ium-1-yl]ethanolate; lanthanum; dihydroxide; hydrate Formula: C22H38La3N4O17+2 MolecularWeight: 1047.27022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[N+](=C1)CC(O)[O-])COC2=CC=C(C=C2)OCC3=C[N+](=CC=C3)CC(O)[O-].[N+](=O)(O)O.[N+](=O)(O)O.[OH3+].[OH3+].O.[OH-].[OH-].[La].[La].[La]

Isomeric SMILES

C1=CC(=C[N+](=C1)CC(O)[O-])COC2=CC=C(C=C2)OCC3=C[N+](=CC=C3)CC(O)[O-].[N+](=O)(O)O.[N+](=O)(O)O.[OH3+].[OH3+].O.[OH-].[OH-].[La].[La].[La]

InChI

InChI=1S/C22H24N2O6.3La.2H2NO3.5H2O/c25-21(26)13-23-9-1-3-17(11-23)15-29-19-5-7-20(8-6-19)30-16-18-4-2-10-24(12-18)14-22(27)28;;;;2*2-1(3)4;;;;;/h1-12,21-22,25,27H,13-16H2;;;;2*(H2,2,3,4);5*1H2/q;;;;2*+1;;;;;