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Substance Name: 4-(Acetoxymethylnitrosamino)-1-(3-pyridyl)-1-butanone
RN: 127686-49-1
InChIKey: PGOGEOISASKDLL-UHFFFAOYSA-N

Note

  • A pyridyloxobutylating agent used for altering DNA.

Classification Code

  • Mutation Data

Molecular Formula

  • C12-H15-N3-O4

Molecular Weight

  • 265.267
 
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Names and Synonyms

Name of Substance

  • 4-(Acetoxymethylnitrosamino)-1-(3-pyridyl)-1-butanone

Synonyms

  • 4-(((Acetyloxy)methyl)nitrosoamino)-1-(3-pyridinyl)-1-butanone
  • 4-((Acetoxymethy)nitrosamino)-1-(3-pyridyl)-1-butanone
  • 4-(Acetoxymethylnitrosamino)-1-(3-pyridyl)-1-butanone
  • 4-(Acetoxymethylnitrosoamino)-1-(3-pyridyl)-1-butanone

Systematic Name

  • 1-Butanone, 4-(((acetyloxy)methyl)nitrosoamino)-1-(3-pyridinyl)-

Registry Numbers

CAS Registry Number

  • 127686-49-1

System Generated Number

  • 0127686491

Structure Descriptors

InChI

1S/C12H15N3O4/c1-10(16)19-9-15(14-18)7-3-5-12(17)11-4-2-6-13-8-11/h2,4,6,8H,3,5,7,9H2,1H3

InChIKey

PGOGEOISASKDLL-UHFFFAOYSA-N

Smiles

c1ncc(C(=O)CCCN(COC(C)=O)N=O)cc1