basic_info |
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| Product_Name: | 1-ISOQUINOLINAMINE, 3,4-DIHYDRO-3-(3'-METHOXY[1,1'-BIPHENYL]-3-YL)-, CF3COOH SALT |
| CAS: | 937370-62-2 |
| EnglishSynonyms: | 1-ISOQUINOLINAMINE, 3,4-DIHYDRO-3-(3'-METHOXY[1,1'-BIPHENYL]-3-YL)-, CF3COOH SALT ; 1-ISOQUINOLINAMINE-3,4-DIHYDRO-3-(3'-METHOXY[1,1'-BIPHENYL]-3-YL)-2,2,2-TRIFLUOROACETATE (1:1) |
| pro_mdlNumber: | MFCD16038894 |
| pro_acceptors: | 3 |
| pro_donors: | 1 |
| pro_smile: | COc1cccc(c1)c2cccc(c2)C3Cc4ccccc4C(=N3)N.C(=O)(C(F)(F)F)O |
| InChi: | InChI=1S/C22H20N2O.C2HF3O2/c1-25-19-10-5-8-16(13-19)15-7-4-9-18(12-15)21-14-17-6-2-3-11-20(17)22(23)24-21;3-2(4,5)1(6)7/h2-13,21H,14H2,1H3,(H2,23,24);(H,6,7) |
| InChiKey: | InChIKey=YRWAUSCCJAWRNU-UHFFFAOYSA-N |
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