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Substance Name: NSC 212045
RN: 25300-13-4
UNII: 8WHAFUGOPX
InChIKey: QPEKKVLAZLZGHF-UHFFFAOYSA-N

Note

  • Selectively inhibits enzymes of serum complement system.

Molecular Formula

  • C20-H15-Cl3-F-N2-O4-S.Br

Molecular Weight

  • 584.6755
 
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Names and Synonyms

Results Name

  • NSC 212045

Name of Substance

  • 3-(3,4-Dichlorophenoxyacetamido)-N-(3-chloro-2-fluorosulfonylbenzyl)pyridinium bromide

Synonyms

  • 2-(3,4-Dichlorophenoxyacetamido)-N-(3-chloro-2-fluorosulfonylbenzyl)pyridinium bromide
  • NSC 212045
  • UNII-8WHAFUGOPX

Systematic Names

  • Pyridinium, 1-((3-chloro-2-(fluorosulfonyl)phenyl)methyl)-3-(((3,4-dichlorophenoxy)acetyl)amino)-, bromide
  • Pyridinium, 1-(3-chloro-2-(fluorosulfonyl)benzyl)-3-(2-(3,4-dichlorophenoxy)acetamido)-, bromide

Registry Numbers

CAS Registry Number

  • 25300-13-4

FDA UNII

  • 8WHAFUGOPX

System Generated Number

  • 0025300134

Molecular Formulas

Molecular Formula

  • C20-H15-Cl3-F-N2-O4-S.Br

Molecular Formula Fragments

  • Br
  • C20-H15-Cl3-F-N2-O4-S
  • COMPONENT

Structure Descriptors

InChI

1S/C20H14Cl3FN2O4S.BrH/c21-16-7-6-15(9-18(16)23)30-12-19(27)25-14-4-2-8-26(11-14)10-13-3-1-5-17(22)20(13)31(24,28)29;/h1-9,11H,10,12H2;1H

InChIKey

QPEKKVLAZLZGHF-UHFFFAOYSA-N

Smiles

c1cc(c(c(c1)Cl)S(=O)(=O)F)C[n+]2cccc(c2)NC(=O)COc3ccc(c(c3)Cl)Cl.[Br-]