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Substance Name: OR 1246
RN: 132759-68-3
InChIKey: PNLAJNRGHNFIDP-UHFFFAOYSA-N

Molecular Formula

  • C12-H13-N-O6

Molecular Weight

  • 267.2357
 
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Names and Synonyms

Name of Substance

  • OR 1246

Synonyms

  • 3-((3,4-Dihydroxy-5-nitrophenyl)methyl)-2,5-pentanedione
  • OR-1246

Systematic Name

  • 2,5-Pentanedione, 3-((3,4-dihydroxy-5-nitrophenyl)methyl)-

Registry Numbers

CAS Registry Number

  • 132759-68-3

System Generated Number

  • 0132759683

Structure Descriptors

InChI

1S/C12H13NO6/c1-6(14)9(7(2)15)3-8-4-10(13(18)19)12(17)11(16)5-8/h4-5,9,16-17H,3H2,1-2H3

InChIKey

PNLAJNRGHNFIDP-UHFFFAOYSA-N

Smiles

CC(=O)C(Cc1cc(c(c(c1)O)O)[N+](=O)[O-])C(=O)C