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Substance Name: Azidopine
RN: 90523-31-2
UNII: 63XR70204A
InChIKey: SWMHKFTXBOJETC-UHFFFAOYSA-N

Classification Codes

  • Affinity Labels
  • Indicators and Reagents

Molecular Formula

  • C27-H26-F3-N5-O5

Molecular Weight

  • 557.5264
 
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Names and Synonyms

Name of Substance

  • Azidopine

Synonym

  • UNII-63XR70204A

Systematic Name

  • 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(2-(trifluoromethyl)phenyl)-, 2-((4-azidobenzoyl)amino)ethyl ethyl ester

Registry Numbers

CAS Registry Number

  • 90523-31-2

FDA UNII

  • 63XR70204A

System Generated Number

  • 0090523312

Structure Descriptors

InChI

1S/C27H26F3N5O5/c1-4-39-25(37)21-15(2)33-16(3)22(23(21)19-7-5-6-8-20(19)27(28,29)30)26(38)40-14-13-32-24(36)17-9-11-18(12-10-17)34-35-31/h5-12,23,33H,4,13-14H2,1-3H3,(H,32,36)

InChIKey

SWMHKFTXBOJETC-UHFFFAOYSA-N

Smiles

CCOC(=O)C1=C(NC(=C(C1c2ccccc2C(F)(F)F)C(=O)OCCNC(=O)c3ccc(cc3)N=N#N)C)C