Vitas-M small molecule compound
3-[1-(4-nitrophenyl)-3-oxopentyl]-2-oxo-2H-chromen-4-olate
Catalog ID
STK370474
SMILES CCC(=O)CC(c1c(=O)oc2c(c1[O-])cccc2)c1ccc(cc1)[N+](=O)[O-]
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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 C20H16NO6 MW 366.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17NO6/c1-2-14(22)11-16(12-7-9-13(10-8-12)21(25)26)18-19(23)15-5-3-4-6-17(15)27-20(18)24/h3-10,16,23H,2,11H2,1H3/p-1InChIKey
KYNMKEMSEAXQAD-UHFFFAOYSA-MSynonyms
3(1(4nitrophenyl)3oxopentyl)2oxo2Hchromen4olate
CCC(=O)CC(c1c(=O)oc2c(c1(O))cccc2)c1ccc(cc1)(N+)(=O)(O)
MFCD00367387
ZINC000005408258
ZINC000005408259
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