basic_info |
|
| Product_Name： | RARECHEM AQ NN 0193 |
| EnglishSynonyms： | RARECHEM AQ NN 0193 |
| pro_mdlNumber： | MFCD00490979 |
| pro_acceptors： | 3 |
| pro_donors： | 0 |
| pro_smile： | CCOC(=O)c1cc[n+](cc1)C.Cc1ccc(cc1)S(=O)(=O)[O-] |
| InChi： | InChI=1S/C9H12NO2.C7H8O3S/c1-3-12-9(11)8-4-6-10(2)7-5-8;1-6-2-4-7(5-3-6)11(8,9)10/h4-7H,3H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1 |
| InChiKey： | InChIKey=AGQUUWWBZWORDW-UHFFFAOYSA-M |
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