basic_info |
|
| Product_Name： | HE-CHEMICAL 49755 |
| EnglishSynonyms： | HE-CHEMICAL 49755 |
| pro_mdlNumber： | MFCD18406858 |
| pro_acceptors： | 4 |
| pro_donors： | 2 |
| pro_smile： | c1cc(cc(c1)OC(F)(F)F)c2ccc(c3c2c(c[nH]3)CC#N)O |
| InChi： | InChI=1S/C17H11F3N2O2/c18-17(19,20)24-12-3-1-2-10(8-12)13-4-5-14(23)16-15(13)11(6-7-21)9-22-16/h1-5,8-9,22-23H,6H2 |
| InChiKey： | InChIKey=OBQKRHOYJXQZGY-UHFFFAOYSA-N |
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