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Substance Name: Xanthylium, 9-(2-(ethoxycarbonyl)phenyl)-3,6-bis(ethylamino)-2,7-dimethyl-, tungstate
RN: 97171-90-9
InChIKey: LSMOQVWPMWTGGY-KXRLZDGQSA-L

Molecular Formula

  • C28-H31-N2-O3.x-Unspecified

Molecular Weight

  • 692.4078
 
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Names and Synonyms

Synonym

  • EINECS 306-408-8

Systematic Name

  • Xanthylium, 9-(2-(ethoxycarbonyl)phenyl)-3,6-bis(ethylamino)-2,7-dimethyl-, tungstate

Registry Numbers

CAS Registry Number

  • 97171-90-9

System Generated Number

  • 0097171909

Molecular Formulas

Molecular Formula

  • C28-H31-N2-O3.x-Unspecified

Molecular Formula Fragments

  • C28-H31-N2-O3
  • COMPONENT
  • Unspecified

Structure Descriptors

InChI

1S/C28H30N2O3.2H2O.2O.W/c1-6-29-23-15-25-21(13-17(23)4)27(19-11-9-10-12-20(19)28(31)32-8-3)22-14-18(5)24(30-7-2)16-26(22)33-25;;;;;/h9-16,29H,6-8H2,1-5H3;2*1H2;;;/q;;;;;+2/p-2/b30-24-;;;;;

InChIKey

LSMOQVWPMWTGGY-KXRLZDGQSA-L

Smiles

c12c(c3c(oc1c/c(=N/CC)c(c2)C)cc(c(c3)C)NCC)c1c(C(=O)OCC)cccc1.[W](=O)(=O)(O)O