basic_info |
|
| Product_Name： | 5-CYANO-2-OXO-5-P-TOLYL-CYCLOHEXANECARBOXYLIC ACID ETHYL ESTER |
| EnglishSynonyms： | 5-CYANO-2-OXO-5-P-TOLYL-CYCLOHEXANECARBOXYLIC ACID ETHYL ESTER |
| pro_mdlNumber： | MFCD19691193 |
| pro_acceptors： | 4 |
| pro_donors： | 0 |
| pro_smile： | CCOC(=O)C1CC(CCC1=O)(C#N)c2ccc(cc2)C |
| InChi： | InChI=1S/C17H19NO3/c1-3-21-16(20)14-10-17(11-18,9-8-15(14)19)13-6-4-12(2)5-7-13/h4-7,14H,3,8-10H2,1-2H3 |
| InChiKey： | InChIKey=SITYXRXXGVQBKH-UHFFFAOYSA-N |
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