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Substance Name: Benzoic acid, 4-(((4,5-dihydro-4-oxo-3H-1,2,3-triazino(5,4-b)indol-3-yl)imino)methyl)-
RN: 139953-77-8
InChIKey: DOAAFJCBXAUPGL-GIJQJNRQSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C17-H11-N5-O3

Molecular Weight

  • 333.306
 
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Names and Synonyms

Synonyms

  • 4-(((4,5-Dihydro-4-oxo-3H-1,2,3-triazino(5,4-b)indol-3-yl)imino)methyl)benzoic acid
  • BRN 5453619
  • CCRIS 4526

Systematic Names

  • 3,5-Dihydro-3-(((4-carboxyphenyl)methylene)amino)-4H-1,2,3-triazino(5,4-b)indol-4-one
  • Benzoic acid, 4-(((4,5-dihydro-4-oxo-3H-1,2,3-triazino(5,4-b)indol-3-yl)imino)methyl)-

Registry Numbers

CAS Registry Number

  • 139953-77-8

System Generated Number

  • 0139953778

Structure Descriptors

InChI

1S/C17H11N5O3/c23-16-15-14(12-3-1-2-4-13(12)19-15)20-21-22(16)18-9-10-5-7-11(8-6-10)17(24)25/h1-9,19H,(H,24,25)/b18-9+

InChIKey

DOAAFJCBXAUPGL-GIJQJNRQSA-N

Smiles

c1(ccc(cc1)C(O)=O)\C=N\n1nnc2c3ccccc3[nH]c2c1=O