Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1,5-Naphthalenedisulfonic acid, 3,3'-(1,3-propanediylbis(imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(2-(acetylamino)-4,1-phenylene)-2,1-diazenediyl))bis-, sodium salt (1:?)
RN: 149850-32-8
InChIKey: WVPDROULCYGDNU-VXINPHEDSA-N

Classification Code

  • TSCA Flag PMN (a Commenced PMN (Premanufacture Notice) Substance)

Molecular Formula

  • C45-H38-F2-N16-O14-S4.x-Na

Molecular Weight

  • 1216.1432
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Regulatory Agencies (Superlist Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

  • 1,5-Naphthalenedisulfonic acid, 3,3'-(1,3-propanediylbis(imino(6-fluoro-1,3,5-triazine-4,2-diyl)imino(2-(acetylamino)-4,1-phenylene)-2,1-diazenediyl))bis-, sodium salt (1:?)

Registry Numbers

CAS Registry Number

  • 149850-32-8

System Generated Number

  • 0149850328

Structure Descriptors

InChI

1S/C45H38F2N16O14S4.Na/c1-22(64)50-34-18-24(10-12-32(34)62-60-26-16-30-28(38(20-26)80(72,73)74)6-3-8-36(30)78(66,67)68)52-44-56-40(46)54-42(58-44)48-14-5-15-49-43-55-41(47)57-45(59-43)53-25-11-13-33(35(19-25)51-23(2)65)63-61-27-17-31-29(39(21-27)81(75,76)77)7-4-9-37(31)79(69,70)71;/h3-4,6-13,16-21H,5,14-15H2,1-2H3,(H,50,64)(H,51,65)(H,66,67,68)(H,69,70,71)(H,72,73,74)(H,75,76,77)(H2,48,52,54,56,58)(H2,49,53,55,57,59);/q;+1/b62-60+,63-61+;

InChIKey

WVPDROULCYGDNU-VXINPHEDSA-N

Smiles

[Na+].CC(=O)Nc1cc(Nc2nc(F)nc(NCCCNc3nc(F)nc(Nc4ccc(N=Nc5cc(c6cccc(c6c5)S(=O)(=O)O)S(=O)(=O)O)c(NC(=O)C)c4)n3)n2)ccc1N=Nc7cc(c8cccc(c8c7)S(=O)(=O)O)S(=O)(=O)O