basic_info |
|
| Product_Name： | AURORA 4498 |
| EnglishSynonyms： | AURORA 4498 |
| pro_mdlNumber： | MFCD01847934 |
| pro_acceptors： | 7 |
| pro_donors： | 1 |
| pro_smile： | CCCCCCOC(=O)C1=CC=C(NC(=O)C2=C(Cl)C=C(C=C2)[N+]([O-])=O)C=C1 |
| InChi： | InChI=1S/C20H21ClN2O5/c1-2-3-4-5-12-28-20(25)14-6-8-15(9-7-14)22-19(24)17-11-10-16(23(26)27)13-18(17)21/h6-11,13H,2-5,12H2,1H3,(H,22,24) |
| InChiKey： | InChIKey=HKKMISWGVONRBT-UHFFFAOYSA-N |
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