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Substance Name: 2'-Des(1-hydroxy-1-methylethyl)-2'-methycarboxy montelukast
RN: 851755-56-1
UNII: KUW20633YM
InChIKey: FVMXWBDOMBDOJN-JLBZDQGGSA-N

Molecular Formula

  • C34-H32-Cl-N-O4-S

Molecular Weight

  • 586.1488
 
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Names and Synonyms

Name of Substance

  • 2'-Des(1-hydroxy-1-methylethyl)-2'-methycarboxy montelukast

Synonyms

  • (+)-Des(1-hydroxy-1-methylethyl) methycarboxy montelukast
  • (1-((((1R)-1-(3-((E)-2-(7-Chloroquinolin-2-yl)ethenyl)phenyl)-3-(2-(methoxycarbonyl)phenyl)propyl)sulfanyl)methyl)cyclopropyl)acetic acid
  • 2'-Des(1-hydroxy-1-methylethyl)-2'-methycarboxy montelukast
  • Benzoic acid, 2-((3R)-3-(((1-(carboxymethyl)cyclopropyl)methyl)thio)-3-(3-((1E)-2-(7-chloro-2-quinolinyl)ethenyl)phenyl)propyl)-, 1-methyl ester
  • DES(1-hydroxy-1-methylethyl) methycarboxy montelukast
  • Montelukast methyl ester
  • Montelukast sodium impurity H [EP]
  • UNII-KUW20633YM

Registry Numbers

CAS Registry Number

  • 851755-56-1

FDA UNII

  • KUW20633YM

System Generated Number

  • 0851755561

Structure Descriptors

InChI

1S/C34H32ClNO4S/c1-40-33(39)29-8-3-2-6-24(29)12-16-31(41-22-34(17-18-34)21-32(37)38)26-7-4-5-23(19-26)9-14-28-15-11-25-10-13-27(35)20-30(25)36-28/h2-11,13-15,19-20,31H,12,16-18,21-22H2,1H3,(H,37,38)/b14-9+/t31-/m1/s1

InChIKey

FVMXWBDOMBDOJN-JLBZDQGGSA-N

Smiles

COC(=O)c1ccccc1CC[C@H](c2cccc(c2)/C=C/c3ccc4ccc(cc4n3)Cl)SCC5(CC5)CC(=O)O