Vitas-M small molecule compound
3-hydroxy-4-(4-nitrophenyl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Catalog ID
STK333185
SMILES O=C1CCCC2=C1C(c1ccc(cc1)[N+](=O)[O-])c1c(N2)[nH]nc1O
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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 C16H14N4O4 MW 326.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O4/c21-11-3-1-2-10-13(11)12(14-15(17-10)18-19-16(14)22)8-4-6-9(7-5-8)20(23)24/h4-7,12H,1-3H2,(H3,17,18,19,22)InChIKey
XYUSCWMVQRYTGV-UHFFFAOYSA-NSynonyms
3hydroxy4(4nitrophenyl)146789hexahydro5Hpyrazolo(34b)quinolin5one
4(4nitrophenyl)246789hexahydro1Hpyrazolo(34b)quinoline35dione
C1CC2=C(C(C3=C(N2)NNC3=O)C4=CC=C(C=C4)(N+)(=O)(O))C(=O)C1
InChI=1SC16H14N4O4c21113121013(11)12(1415(1710)181916(14)22)8469(758)20(23)24h4712H13H2(H317181922)
MFCD09962879
O=C1CCCC2=C1C(c1ccc(cc1)(N+)(=O)(O))c1c(N2)(nH)nc1O
ZINC000018195469
ZINC000018195471
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