basic_info |
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| Product_Name: | 1H-ISOINDOL-1-ONE, 5-(2-CHLORO-4-METHOXYPHENYL)-4-(4-CHLOROPHENYL)OCTAHYDRO-3,7A-DIMETHYL-, (3R,3AS,4S,5R,7AR)- |
| CAS: | 944813-02-9 |
| EnglishSynonyms: | 1H-ISOINDOL-1-ONE, 5-(2-CHLORO-4-METHOXYPHENYL)-4-(4-CHLOROPHENYL)OCTAHYDRO-3,7A-DIMETHYL-, (3R,3AS,4S,5R,7AR)- |
| pro_mdlNumber: | MFCD16037587 |
| pro_acceptors: | 3 |
| pro_donors: | 1 |
| pro_smile: | C[C@@H]1[C@H]2[C@H]([C@@H](CC[C@]2(C(=O)N1)C)c3ccc(cc3Cl)OC)c4ccc(cc4)Cl |
| InChi: | InChI=1S/C23H25Cl2NO2/c1-13-21-20(14-4-6-15(24)7-5-14)18(10-11-23(21,2)22(27)26-13)17-9-8-16(28-3)12-19(17)25/h4-9,12-13,18,20-21H,10-11H2,1-3H3,(H,26,27)/t13-,18+,20+,21+,23-/m1/s1 |
| InChiKey: | InChIKey=KBDWXFPMJKLTOE-LNAXAKQZSA-N |
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