basic_info |
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Product_Name: | ETHYL 6-CHLORO-4-(3-CYANOBENZYLAMINO)NICOTINATE |
EnglishSynonyms: | ETHYL 6-CHLORO-4-(3-CYANOBENZYLAMINO)NICOTINATE |
pro_mdlNumber: | MFCD22681851 |
pro_acceptors: | 5 |
pro_donors: | 1 |
pro_smile: | CCOC(=O)c1cnc(cc1NCc2cccc(c2)C#N)Cl |
InChi: | InChI=1S/C16H14ClN3O2/c1-2-22-16(21)13-10-20-15(17)7-14(13)19-9-12-5-3-4-11(6-12)8-18/h3-7,10H,2,9H2,1H3,(H,19,20) |
InChiKey: | InChIKey=FEZOPXXEJCDXDY-UHFFFAOYSA-N |
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