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Substance Name: 12-N-Methyl-7-nitrobenzo-2-oxa-1,3-diazolamino stearate
RN: 117056-67-4
InChIKey: SAAVELCIPHKGJE-UHFFFAOYSA-N

Molecular Formula

  • C25-H40-N4-O5

Molecular Weight

  • 476.614
 
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Names and Synonyms

Name of Substance

  • 12-N-Methyl-7-nitrobenzo-2-oxa-1,3-diazolamino stearate

Synonyms

  • 12-Nbds
  • Nbd-stearate

Systematic Name

  • Octadecanoic acid, 12-(methyl(7-nitro-4-benzofurazanyl)amino)-

Registry Numbers

CAS Registry Number

  • 117056-67-4

System Generated Number

  • 0117056674

Structure Descriptors

InChI

1S/C25H40N4O5/c1-3-4-5-12-15-20(16-13-10-8-6-7-9-11-14-17-23(30)31)28(2)21-18-19-22(29(32)33)25-24(21)26-34-27-25/h18-20H,3-17H2,1-2H3,(H,30,31)

InChIKey

SAAVELCIPHKGJE-UHFFFAOYSA-N

Smiles

CCCCCCC(CCCCCCCCCCC(=O)O)N(C)c1ccc(c2c1non2)[N+](=O)[O-]