basic_info |
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| Product_Name: | 5-ACETYL-2,6-DIMETHYL-4-(4-NITROPHENYL)-1,4-DIHYDRO-3-PYRIDINECARBOXYLIC ACID |
| CAS: | 219553-55-6 |
| EnglishSynonyms: | 5-ACETYL-2,6-DIMETHYL-4-(4-NITROPHENYL)-1,4-DIHYDRO-3-PYRIDINECARBOXYLIC ACID |
| pro_mdlNumber: | MFCD02571463 |
| pro_acceptors: | 7 |
| pro_donors: | 2 |
| pro_smile: | CC1=C(C(C(=C(N1)C)C(=O)O)c2ccc(cc2)[N+](=O)[O-])C(=O)C |
| InChi: | InChI=1S/C16H16N2O5/c1-8-13(10(3)19)15(14(16(20)21)9(2)17-8)11-4-6-12(7-5-11)18(22)23/h4-7,15,17H,1-3H3,(H,20,21) |
| InChiKey: | InChIKey=QIIHVPCLWJLLFI-UHFFFAOYSA-N |
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