basic_info |
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| Product_Name: | (2E)-3-([4-(ETHOXYCARBONYL)PHENYL]CARBAMOYL)PROP-2-ENOIC ACID |
| CAS: | 53616-17-4 |
| EnglishSynonyms: | 4-[4-(ETHOXYCARBONYL)ANILINO]-4-OXOBUT-2-ENOIC ACID ; 4-(3-CARBOXY-ACRYLOYLAMINO)-BENZOIC ACID ETHYL ESTER ; (2E)-3-([4-(ETHOXYCARBONYL)PHENYL]CARBAMOYL)PROP-2-ENOIC ACID ; 4'-(ETHOXYCARBONYL)-MALEANILIC ACID |
| pro_mdlNumber: | MFCD00020479 |
| pro_acceptors: | 6 |
| pro_donors: | 2 |
| pro_smile: | CCOC(=O)c1ccc(cc1)NC(=O)/C=C/C(=O)O |
| InChi: | InChI=1S/C13H13NO5/c1-2-19-13(18)9-3-5-10(6-4-9)14-11(15)7-8-12(16)17/h3-8H,2H2,1H3,(H,14,15)(H,16,17)/b8-7+ |
| InChiKey: | InChIKey=PGHXVUXXQIGFAM-BQYQJAHWSA-N |
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