basic_info |
|
Product_Name: | HE-CHEMICAL 49758 |
EnglishSynonyms: | HE-CHEMICAL 49758 |
pro_mdlNumber: | MFCD18406861 |
pro_acceptors: | 4 |
pro_donors: | 2 |
pro_smile: | c1cc(cc(c1)OC(F)(F)F)c2cc3c(c[nH]c3c(c2)O)CC#N |
InChi: | InChI=1S/C17H11F3N2O2/c18-17(19,20)24-13-3-1-2-10(6-13)12-7-14-11(4-5-21)9-22-16(14)15(23)8-12/h1-3,6-9,22-23H,4H2 |
InChiKey: | InChIKey=JABODCAYPRYQFS-UHFFFAOYSA-N |
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