Vitas-M small molecule compound
5-hydroxy-7-oxo-3-phenyl-6-azabicyclo[3.2.1]octane-1,2,2-tricarbonitrile
Catalog ID
STK546215
SMILES N#CC1(C#N)C(CC2(CC1(C#N)C(=O)N2)O)c1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C16H12N4O2 MW 292.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N4O2/c17-8-14-7-16(22,20-13(14)21)6-12(15(14,9-18)10-19)11-4-2-1-3-5-11/h1-5,12,22H,6-7H2,(H,20,21)InChIKey
WSNLJOMJIFIAJH-UHFFFAOYSA-NSynonyms
342405-78-11HYDROXY6OXO3PHENYL7AZABICYCLO(321)OCTANE445TRICARBONITRILE
342405781
5hydroxy7oxo3phenyl6azabicyclo(321)octane122tricarbonitrile
C1C(C(C2(CC1(NC2=O)O)C#N)(C#N)C#N)C3=CC=CC=C3
InChI=1SC16H12N4O2c17814716(222013(14)21)612(15(14918)1019)114213511h151222H67H2(H2021)
MFCD01953757
ZINC000000127629
ZINC000013686503
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