basic_info |
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Product_Name: | 4-[(2-METHOXYBENZYL)AMINO]-4-OXO-2-BUTENOIC ACID |
EnglishSynonyms: | 4-[(2-METHOXYBENZYL)AMINO]-4-OXO-2-BUTENOIC ACID |
pro_mdlNumber: | MFCD15976946 |
pro_acceptors: | 5 |
pro_donors: | 2 |
pro_smile: | COc1ccccc1CNC(=O)/C=C\C(=O)O |
InChi: | InChI=1S/C12H13NO4/c1-17-10-5-3-2-4-9(10)8-13-11(14)6-7-12(15)16/h2-7H,8H2,1H3,(H,13,14)(H,15,16)/b7-6- |
InChiKey: | InChIKey=KENHBHGDLWMTBW-SREVYHEPSA-N |
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