basic_info |
|
| Product_Name: | BENEXATE HYDROCHLORIDE |
| CAS: | 78718-25-9 |
| EnglishSynonyms: | BENEXATE HYDROCHLORIDE ; BENEXATE HCL |
| pro_mdlNumber: | MFCD09752663 |
| pro_acceptors: | 7 |
| pro_donors: | 3 |
| pro_smile: | c1ccc(cc1)COC(=O)c2ccccc2OC(=O)[C@H]3CC[C@@H](CC3)CNC(=N)N.Cl |
| InChi: | InChI=1S/C23H27N3O4.ClH/c24-23(25)26-14-16-10-12-18(13-11-16)21(27)30-20-9-5-4-8-19(20)22(28)29-15-17-6-2-1-3-7-17;/h1-9,16,18H,10-15H2,(H4,24,25,26);1H/t16-,18-; |
| InChiKey: | InChIKey=ZNYYFCHDQJQKOK-AELULUIVSA-N |
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