Vitas-M small molecule compound
ethyl 3-{4-methyl-7-[(4-nitrobenzyl)oxy]-2-oxo-2H-chromen-3-yl}propanoate
Catalog ID
STL463214
SMILES CCOC(=O)CCc1c(=O)oc2c(c1C)ccc(c2)OCc1ccc(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 C22H21NO7 MW 411.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO7/c1-3-28-21(24)11-10-19-14(2)18-9-8-17(12-20(18)30-22(19)25)29-13-15-4-6-16(7-5-15)23(26)27/h4-9,12H,3,10-11,13H2,1-2H3InChIKey
PXDKXDHECIHOGB-UHFFFAOYSA-NSynonyms
701288-73-5701288735
CCOC(=O)CCC1=C(C2=C(C=C(C=C2)OCC3=CC=C(C=C3)(N+)(=O)(O))OC1=O)C
CCOC(=O)CCc1c(=O)oc2c(c1C)ccc(c2)OCc1ccc(cc1)(N+)(=O)(O)
ethyl3(4methyl7((4nitrobenzyl)oxy)2oxo2Hchromen3yl)propanoate
ETHYL3(4METHYL7((4NITROPHENYL)METHOXY)2OXOCHROMEN3YL)PROPANOATE
InChI=1SC22H21NO7c132821(24)11101914(2)189817(1220(18)3022(19)25)2913154616(7515)23(26)27h4912H3101113H212H3
MFCD03853068
ZINC000001118290
ZINC01118290
ZINC1118290
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