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Substance Name: Xanthylium, 9-(2-(ethoxycarbonyl)phenyl)-3,6-bis(ethylamino)-2,7-dimethyl-, (T-4)-tetraoxomolybdate(2-) (2:1)
RN: 65366-87-2
InChIKey: SITGPQKGUATHOE-UHFFFAOYSA-N

Molecular Formula

  • C28-H31-N2-O3.1/2Mo-O4

Molecular Weight

  • 603.5
 
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Names and Synonyms

Synonym

  • EINECS 265-717-5

Systematic Names

  • Bis(9-(2-(ethoxycarbonyl)phenyl)-3,6-bis(ethylamino)-2,7-dimethylxanthylium) tetraoxomolybdate(2-)
  • Xanthylium, 9-(2-(ethoxycarbonyl)phenyl)-3,6-bis(ethylamino)-2,7-dimethyl-, (T-4)-tetraoxomolybdate(2-) (2:1)

Registry Numbers

CAS Registry Number

  • 65366-87-2

Related Registry Number

  • 989-38-8 (Parent)

System Generated Number

  • 0065366872

Molecular Formulas

Molecular Formula

  • C28-H31-N2-O3.1/2Mo-O4

Molecular Formula Fragments

  • C28-H31-N2-O3
  • COMPONENT
  • Mo-O4

Structure Descriptors

InChI

1S/C28H31N2O3.Mo.4O/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;;;;;/h9-16,29-30H,6-8H2,1-5H3;;;;;/q+1;-2;;;;

InChIKey

SITGPQKGUATHOE-UHFFFAOYSA-N

Smiles

c1(cc2c(cc1NCC)[o+]c1c(cc(c(NCC)c1)C)c2c1c(C(OCC)=O)cccc1)C.[Mo-2](=O)(=O)(=O)=O