basic_info |
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Product_Name: | 3-BROMO-2-[(1-ETHOXY-1-OXOBUTAN-2-YL)OXY]BENZOIC ACID |
EnglishSynonyms: | 3-BROMO-2-[(1-ETHOXY-1-OXOBUTAN-2-YL)OXY]BENZOIC ACID |
pro_mdlNumber: | MFCD20097614 |
pro_acceptors: | 5 |
pro_donors: | 1 |
pro_smile: | CCC(C(=O)OCC)Oc1c(cccc1Br)C(=O)O |
InChi: | InChI=1S/C13H15BrO5/c1-3-10(13(17)18-4-2)19-11-8(12(15)16)6-5-7-9(11)14/h5-7,10H,3-4H2,1-2H3,(H,15,16) |
InChiKey: | InChIKey=KBMIVTIDZQTJCJ-UHFFFAOYSA-N |
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