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Substance Name: Cromitrile sodium [USAN]
RN: 53736-52-0
UNII: Z9FYZ8P9ND
InChIKey: DRMAOJOMESIGKD-UHFFFAOYSA-M

Classification Codes

  • Anti-Asthmatic
  • Drug / Therapeutic Agent

Molecular Formulas

  • C20-H14-N5-Na-O5
  • C20-H14-N5-O5.Na

Molecular Weight

  • 427.3506
 
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Names and Synonyms

Name of Substance

  • Cromitrile sodium [USAN]

Synonyms

  • (+-)-p-(2-Hydroxy-3-((4-oxo-2-(1H-tetrazol-5-yl)-4H-1-benzopyran-5-yl)oxy)propoxy)benzonitrile monosodium salt
  • Benzonitrile, 4-(2-hydroxy-3-((4-oxo-2-(1H-tetrazol-5-yl)-4H-1-benzopyran-5-yl)oxy)propoxy)-, monosodium salt, (+-)-
  • Cromitrile sodium
  • Sodium 1-(4-cyanophenoxy)-2-hydroxy-3-(2-(5-1H-tetrazolyl)chromon-5-yloxy)propane
  • TR 2855
  • TR-2855
  • UNII-Z9FYZ8P9ND

Systematic Names

  • Benzonitrile, 4-(2-hydroxy-3-((4-oxo-2-(1H-tetrazol-5-yl)-4H-1-benzopyran-5-yl)oxy)propoxy)-, monosodium salt, (+-)-
  • Benzonitrile, 4-(2-hydroxy-3-((4-oxo-2-(1H-tetrazol-5-yl)-4H-1-benzopyran-5-yl)oxy)propoxy)-,monosodium salt

Registry Numbers

CAS Registry Number

  • 53736-52-0

FDA UNII

  • Z9FYZ8P9ND

System Generated Number

  • 0053736520

Molecular Formulas

Molecular Formulas

  • C20-H14-N5-Na-O5
  • C20-H14-N5-O5.Na

Molecular Formula Fragments

  • C20-H14-N5-O5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C20H15N5O5.Na/c21-9-12-4-6-14(7-5-12)28-10-13(26)11-29-16-2-1-3-17-19(16)15(27)8-18(30-17)20-22-24-25-23-20;/h1-8,13,26H,10-11H2,(H,22,23,24,25,27);/q;+1/p-1

InChIKey

DRMAOJOMESIGKD-UHFFFAOYSA-M

Smiles

c1cc2c(c(c1)OCC(COc3ccc(cc3)C#N)O)c(=O)cc(o2)c4[n-]nnn4.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intravenous > 791mg/kg (791mg/kg)   United States Patent Document. Vol. #4238495,