Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: EINECS 263-942-3
RN: 63148-90-3
InChIKey: FWPQPRLLYITZGV-UHFFFAOYSA-N

Molecular Formula

  • C32-H33-Cl-N2-O8-S2.C6-H15-N

Molecular Weight

  • 774.395
 
* 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

Results Name

  • EINECS 263-942-3

Synonym

  • EINECS 263-942-3

Systematic Names

  • Benzoxazolium, 5-chloro-2-(2-((5-phenyl-3-(3-sulfobutyl)-2(3H)-benzoxazolylidene)methyl)-1-buten-1-yl)-3-(3-sulfopropyl)-, inner salt, compd. with N,N-diethylethanamine (1:1)
  • Benzoxazolium, 5-chloro-2-(2-((5-phenyl-3-(3-sulfobutyl)-2(3H)-benzoxazolylidene)methyl)-1-butenyl)-3-(3-sulfopropyl)-, hydroxide, inner salt, compd. with N,N-diethylethanamine (1:1)
  • Benzoxazolium, 5-chloro-2-(2-((5-phenyl-3-(3-sulfobutyl)-2(3H)-benzoxazolylidene)methyl)-1-butenyl)-3-(3-sulfopropyl)-, inner salt, compd. with N,N-diethylethanamine (1:1)
  • Hydrogen 5-chloro-2-(2-((5-phenyl-3-(3-sulphonatobutyl)-3H-benzoxazol-2-ylidene)methyl)but-1-enyl)-3-(3-sulphonatopropyl)benzoxazolium, compound with triethylamine (1:1)

Registry Numbers

CAS Registry Number

  • 63148-90-3

Other Registry Numbers

  • 160681-90-3
  • 285567-32-0
  • 330568-97-3
  • 415896-80-9

System Generated Number

  • 0063148903

Molecular Formulas

Molecular Formula

  • C32-H33-Cl-N2-O8-S2.C6-H15-N

Molecular Formula Fragments

  • C32-H33-Cl-N2-O8-S2
  • C6-H15-N
  • COMPONENT

Structure Descriptors

InChI

1S/C32H33ClN2O8S2.C6H15N/c1-3-23(18-31-34(15-7-17-44(36,37)38)28-21-26(33)11-13-30(28)43-31)19-32-35(16-14-22(2)45(39,40)41)27-20-25(10-12-29(27)42-32)24-8-5-4-6-9-24;1-4-7(5-2)6-3/h4-6,8-13,18-22H,3,7,14-17H2,1-2H3,(H-,36,37,38,39,40,41);4-6H2,1-3H3

InChIKey

FWPQPRLLYITZGV-UHFFFAOYSA-N

Smiles

o1c(\C=C(/CC)\C=C2/Oc3c(N2CC[C@@H](C)S(=O)(=O)O)cc(cc3)c2ccccc2)[n+](CCCS(=O)(=O)[O-])c2c1ccc(Cl)c2.N(CC)(CC)CC