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Substance Name: Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, methyl sulfate (1:2)
RN: 72796-88-4
InChIKey: KZUDMOOKIUOVCC-UHFFFAOYSA-M

Molecular Formula

  • C42-H54-N2-O2.2C-H3-O4-S

Molecular Weight

  • 729.997
 
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Names and Synonyms

Synonyms

  • EINECS 276-840-9
  • Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate)

Systematic Names

  • (2,2'-((1,1'-Biphenyl)-4,4'-diylbis(ethylenephenyleneoxy))diethyl)bis(diethylmethylammonium) dimethyl bis(sulphate)
  • Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, bis(methyl sulfate)
  • Ethanaminium, 2,2'-((1,1'-biphenyl)-4,4'-diylbis(2,1-ethenediyl-2,1-phenyleneoxy))bis(N,N-diethyl-N-methyl-, methyl sulfate (1:2)

Registry Numbers

CAS Registry Number

  • 72796-88-4

System Generated Number

  • 0072796884

Molecular Formulas

Molecular Formula

  • C42-H54-N2-O2.2C-H3-O4-S

Molecular Formula Fragments

  • C-H3-O4-S
  • C42-H54-N2-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C42H54N2O2.CH4O4S/c1-7-43(5,8-2)31-33-45-41-25-13-11-23-39(41,27-29-41)37-19-15-35(16-20-37)36-17-21-38(22-18-36)40-24-12-14-26-42(40,30-28-40)46-34-32-44(6,9-3)10-4;1-5-6(2,3)4/h11-30H,7-10,31-34H2,1-6H3;1H3,(H,2,3,4)/q+2;/p-1

InChIKey

KZUDMOOKIUOVCC-UHFFFAOYSA-M

Smiles

c1(c2ccc(cc2)[C@@]23[C@@](C=CC=C2)(OCC[N+](C)(CC)CC)C=C3)ccc([C@@]23[C@@](C=CC=C2)(OCC[N+](C)(CC)CC)C=C3)cc1.S(=O)(=O)(OC)[O-]