basic_info |
|
| Product_Name： | 5-(4-BROMO-PHENYL)-5-CYANO-2-OXO-CYCLOHEXANECARBOXYLIC ACID ETHYL ESTER |
| EnglishSynonyms： | 5-(4-BROMO-PHENYL)-5-CYANO-2-OXO-CYCLOHEXANECARBOXYLIC ACID ETHYL ESTER |
| pro_mdlNumber： | MFCD19691200 |
| pro_acceptors： | 4 |
| pro_donors： | 0 |
| pro_smile： | CCOC(=O)C1CC(CCC1=O)(C#N)c2ccc(cc2)Br |
| InChi： | InChI=1S/C16H16BrNO3/c1-2-21-15(20)13-9-16(10-18,8-7-14(13)19)11-3-5-12(17)6-4-11/h3-6,13H,2,7-9H2,1H3 |
| InChiKey： | InChIKey=YEJSXNNBNYEXDA-UHFFFAOYSA-N |
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