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Substance Name: Benzonitrile, 3-((4-(5-(methoxymethyl)-2-oxo-3-oxazolidinyl)phenyl)ethynyl)-
RN: 79039-09-1
InChIKey: ABKGIBGQBAKROB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H16-N2-O3

Molecular Weight

  • 332.3574
 
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Names and Synonyms

Synonym

  • 3-((4-(5-(Methoxymethyl)-2-oxo-3-oxazolidinyl)phenyl)ethynyl)benzonitrile

Systematic Name

  • Benzonitrile, 3-((4-(5-(methoxymethyl)-2-oxo-3-oxazolidinyl)phenyl)ethynyl)-

Registry Numbers

CAS Registry Number

  • 79039-09-1

System Generated Number

  • 0079039091

Structure Descriptors

InChI

1S/C20H16N2O3/c1-24-14-19-13-22(20(23)25-19)18-9-7-15(8-10-18)5-6-16-3-2-4-17(11-16)12-21/h2-4,7-11,19H,13-14H2,1H3

InChIKey

ABKGIBGQBAKROB-UHFFFAOYSA-N

Smiles

COCC1CN(C(=O)O1)c2ccc(cc2)C#Cc3cccc(c3)C#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   United States Patent Document. Vol. #4517197,