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Substance Name: Xanthylium, 3,6-bis(ethylamino)-9-(2-((2-hydroxyethoxy)carbonyl)phenyl)-2,7-dimethyl-, chloride (1:1)
RN: 63610-07-1
InChIKey: BHFJTBHQGWUBBN-UHFFFAOYSA-M

Molecular Formula

  • C28-H31-N2-O4.Cl

Molecular Weight

  • 495.016
 
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Names and Synonyms

  • Xanthylium, 3,6-bis(ethylamino)-9-(2-((2-hydroxyethoxy)carbonyl)phenyl)-2,7-dimethyl-, chloride
  • Xanthylium, 3,6-bis(ethylamino)-9-(2-((2-hydroxyethoxy)carbonyl)phenyl)-2,7-dimethyl-, chloride (1:1)

Registry Numbers

CAS Registry Number

  • 63610-07-1

System Generated Number

  • 0063610071

Molecular Formulas

Molecular Formula

  • C28-H31-N2-O4.Cl

Molecular Formula Fragments

  • C28-H31-N2-O4
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C28H31N2O4.ClH/c1-5-29-23-15-25-21(13-17(23)3)27(19-9-7-8-10-20(19)28(32)33-12-11-31)22-14-18(4)24(30-6-2)16-26(22)34-25;/h7-10,13-16,29-31H,5-6,11-12H2,1-4H3;1H/q+1;/p-1

InChIKey

BHFJTBHQGWUBBN-UHFFFAOYSA-M

Smiles

[ClH-].C(OCCO)(=O)c1c(cccc1)c1c2cc(c(cc2[o+]c2c1cc(C)c(NCC)c2)NCC)C