3-phenyl-1-[(3-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)methoxymethyl]-1-azoniabicyclo[2.2.2]octane dibromide

Systemtic Name: 3-phenyl-1-[(3-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)methoxymethyl]-1-azoniabicyclo[2.2.2]octane dibromide Openeye Name: 3-phenyl-1-[(3-phenylquinuclidin-1-ium-1-yl)methoxymethyl]quinuclidin-1-ium dibromide CAS Name: 3-phenyl-1-[(3-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)methoxymethyl]-1-azoniabicyclo[2.2.2]octane dibromide IUPAC Name: 3-phenyl-1-[(3-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)methoxymethyl]-1-azoniabicyclo[2.2.2]octane dibromide Traditional Name: 3-phenyl-1-[(3-phenylquinuclidin-1-ium-1-yl)methoxymethyl]quinuclidin-1-ium dibromide Formula: C28H38Br2N2O MolecularWeight: 578.42212

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCC1C(C2)C3=CC=CC=C3)COC[N+]45CCC(CC4)C(C5)C6=CC=CC=C6.[Br-].[Br-]

Isomeric SMILES

C1C[N+]2(CCC1C(C2)C3=CC=CC=C3)COC[N+]45CCC(CC4)C(C5)C6=CC=CC=C6.[Br-].[Br-]

InChI

InChI=1S/C28H38N2O.2BrH/c1-3-7-23(8-4-1)27-19-29(15-11-25(27)12-16-29)21-31-22-30-17-13-26(14-18-30)28(20-30)24-9-5-2-6-10-24;;/h1-10,25-28H,11-22H2;2*1H/q+2;;/p-2