Vitas-M small molecule compound
ethyl 3-{[(8-methoxy-2-oxo-2H-chromen-3-yl)carbonyl]amino}-3-(3-nitrophenyl)propanoate
Catalog ID
STK770602
SMILES CCOC(=O)CC(c1cccc(c1)[N+](=O)[O-])NC(=O)c1cc2cccc(c2oc1=O)OC
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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 C22H20N2O8 MW 440.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O8/c1-3-31-19(25)12-17(13-6-4-8-15(10-13)24(28)29)23-21(26)16-11-14-7-5-9-18(30-2)20(14)32-22(16)27/h4-11,17H,3,12H2,1-2H3,(H,23,26)InChIKey
PKOQIOVAKQYPJR-UHFFFAOYSA-NSynonyms
CCOC(=O)CC(C1=CC(=CC=C1)(N+)(=O)(O))NC(=O)C2=CC3=C(C(=CC=C3)OC)OC2=O
CCOC(=O)CC(c1cccc(c1)(N+)(=O)(O))NC(=O)c1cc2cccc(c2oc1=O)OC
ethyl3(((8methoxy2oxo2Hchromen3yl)carbonyl)amino)3(3nitrophenyl)propanoate
ETHYL3((8METHOXY2OXOCHROMENE3CARBONYL)AMINO)3(3NITROPHENYL)PROPANOATE
InChI=1SC22H20N2O8c133119(25)1217(1364815(1013)24(28)29)2321(26)16111475918(302)20(14)3222(16)27h41117H312H212H3(H2326)
MFCD03766373
ZINC000003623176
ZINC000003623179
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