Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Sodium 9-methoxy-1,3-dioxo-1H-xantheno(2,1,9-def)isoquinoline-2(3H)-ethanesulphonate
RN: 59454-19-2
InChIKey: OUOSNHUBRUYKMF-UHFFFAOYSA-M

Molecular Formula

  • C21-H15-N-O7-S.Na

Molecular Weight

  • 447.3976
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • EINECS 261-769-8

Systematic Name

  • Sodium 9-methoxy-1,3-dioxo-1H-xantheno(2,1,9-def)isoquinoline-2(3H)-ethanesulphonate

Registry Numbers

CAS Registry Number

  • 59454-19-2

System Generated Number

  • 0059454192

Molecular Formulas

Molecular Formula

  • C21-H15-N-O7-S.Na

Molecular Formula Fragments

  • C21-H15-N-O7-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C21H15NO7S.Na/c1-28-11-2-6-16-15(10-11)12-3-4-13-18-14(5-7-17(29-16)19(12)18)21(24)22(20(13)23)8-9-30(25,26)27;/h2-7,10H,8-9H2,1H3,(H,25,26,27);/q;+1/p-1

InChIKey

OUOSNHUBRUYKMF-UHFFFAOYSA-M

Smiles

[Na+].n1(c(=O)c2c3c(c1=O)ccc1c3c(cc2)c2c(o1)ccc(c2)OC)CCS(=O)(=O)[O-]