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Substance Name: Acetic acid, (2-(1-N-methylcarbamoyl)-3-phenyl)phenoxy-, sodium salt
RN: 63906-41-2
InChIKey: HASNHXSBVHIGQX-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H14-N-O4.Na

Molecular Weight

  • 307.28
 
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Names and Synonyms

Synonym

  • Sodium (2-(1-N-methylcarbamoyl)-3-phenyl)phenoxyacetate

Systematic Name

  • Acetic acid, (2-(1-N-methylcarbamoyl)-3-phenyl)phenoxy-, sodium salt

Registry Numbers

CAS Registry Number

  • 63906-41-2

System Generated Number

  • 0063906412

Molecular Formulas

Molecular Formula

  • C16-H14-N-O4.Na

Molecular Formula Fragments

  • C16-H14-N-O4
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C16H15NO4.Na/c1-17-16(20)15-12(11-6-3-2-4-7-11)8-5-9-13(15)21-10-14(18)19;/h2-9H,10H2,1H3,(H,17,20)(H,18,19);/q;+1/p-1

InChIKey

HASNHXSBVHIGQX-UHFFFAOYSA-M

Smiles

c1(c(c(ccc1)OCC(=O)[O-])C(NC)=O)c1ccccc1.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 750mg/kg (750mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 108, Pg. 450, 1953.