basic_info |
|
| Product_Name： | BENOXATHIAN |
| CAS： | 92642-94-9 |
| EnglishSynonyms： | BENOXATHIAN |
| pro_mdlNumber： | MFCD09842856 |
| pro_acceptors： | 5 |
| pro_donors： | 1 |
| pro_smile： | COc1cccc(c1OCCNCC2CSc3ccccc3O2)OC |
| InChi： | InChI=1S/C19H23NO4S/c1-21-16-7-5-8-17(22-2)19(16)23-11-10-20-12-14-13-25-18-9-4-3-6-15(18)24-14/h3-9,14,20H,10-13H2,1-2H3 |
| InChiKey： | InChIKey=QAUVAHYHKLRJCQ-UHFFFAOYSA-N |
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