Skip Navigation
ChemIDplus LiteBrowseAdvanced

Substance Name: Isosulfan blue inner salt
RN: 748080-29-7
UNII: NS6Q291771
InChIKey: YFKDCGWIINMRQY-UHFFFAOYSA-N

Molecular Weight

  • 544.6898
 
* 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

Name of Substance

  • Isosulfan blue inner salt

Synonyms

  • Ethanaminium, N-(4-((4-(diethylamino)phenyl)(2,5-disulfophenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-ethyl-, inner salt
  • UNII-NS6Q291771

Registry Numbers

CAS Registry Number

  • 748080-29-7

FDA UNII

  • NS6Q291771

System Generated Number

  • 0748080297

Structure Descriptors

InChI

InChI=1S/C27H32N2O6S2/c1-5-28(6-2)22-13-9-20(10-14-22)27(21-11-15-23(16-12-21)29(7-3)8-4)25-19-24(36(30,31)32)17-18-26(25)37(33,34)35/h9-19H,5-8H2,1-4H3,(H-,30,31,32,33,34,35)

InChIKey

YFKDCGWIINMRQY-UHFFFAOYSA-N

Smiles

CCN(CC)c1ccc(cc1)C(=C2C=CC(=[N+](CC)CC)C=C2)c3cc(ccc3S(=O)(=O)[O-])S(=O)(=O)O