Vitas-M small molecule compound
ethyl 3-{7-[(3-bromobenzyl)oxy]-6-chloro-4-methyl-2-oxo-2H-chromen-3-yl}propanoate
Catalog ID
STL226649
SMILES CCOC(=O)CCc1c(=O)oc2c(c1C)cc(c(c2)OCc1cccc(c1)Br)Cl
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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 C22H20BrClO5 MW 479.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrClO5/c1-3-27-21(25)8-7-16-13(2)17-10-18(24)20(11-19(17)29-22(16)26)28-12-14-5-4-6-15(23)9-14/h4-6,9-11H,3,7-8,12H2,1-2H3InChIKey
ZIPXEKIFCHYVBQ-UHFFFAOYSA-NSynonyms
579440-11-2579440112
CCOC(=O)CCC1=C(C2=CC(=C(C=C2OC1=O)OCC3=CC(=CC=C3)Br)Cl)C
ethyl3(7((3bromobenzyl)oxy)6chloro4methyl2oxo2Hchromen3yl)propanoate
ETHYL3(7((3BROMOPHENYL)METHOXY)6CHLORO4METHYL2OXOCHROMEN3YL)PROPANOATE
InChI=1SC22H20BrClO5c132721(25)871613(2)171018(24)20(1119(17)2922(16)26)28121454615(23)914h46911H37812H212H3
MFCD04032478
ZINC000002395902
ZINC02395902
ZINC2395902
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