Vitas-M small molecule compound
ethyl 3-{7-[(4-bromobenzyl)oxy]-4,8-dimethyl-2-oxo-2H-chromen-3-yl}propanoate
Catalog ID
STL463252
SMILES CCOC(=O)CCc1c(=O)oc2c(c1C)ccc(c2C)OCc1ccc(cc1)Br
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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 C23H23BrO5 MW 459.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23BrO5/c1-4-27-21(25)12-10-19-14(2)18-9-11-20(15(3)22(18)29-23(19)26)28-13-16-5-7-17(24)8-6-16/h5-9,11H,4,10,12-13H2,1-3H3InChIKey
XFCWMGVRAODADZ-UHFFFAOYSA-NSynonyms
858754-33-3858754333
CCOC(=O)CCC1=C(C2=C(C(=C(C=C2)OCC3=CC=C(C=C3)Br)C)OC1=O)C
ethyl3(7((4bromobenzyl)oxy)48dimethyl2oxo2Hchromen3yl)propanoate
ETHYL3(7((4BROMOPHENYL)METHOXY)48DIMETHYL2OXOCHROMEN3YL)PROPANOATE
InChI=1SC23H23BrO5c142721(25)12101914(2)1891120(15(3)22(18)2923(19)26)2813165717(24)8616h5911H4101213H213H3
MFCD03853812
ZINC000002151840
ZINC02151840
ZINC2151840
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