basic_info |
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| Product_Name: | 7,8-DIMETHOXY-1-(TOLUENE-4-SULFONYL)-1,2,3,4-TETRAHYDRO-BENZO[B]AZEPIN-5-ONE |
| EnglishSynonyms: | 7,8-DIMETHOXY-1-(TOLUENE-4-SULFONYL)-1,2,3,4-TETRAHYDRO-BENZO[B]AZEPIN-5-ONE |
| pro_mdlNumber: | MFCD00666368 |
| pro_acceptors: | 6 |
| pro_donors: | 0 |
| pro_smile: | Cc1ccc(cc1)S(=O)(=O)N2CCCC(=O)c3c2cc(c(c3)OC)OC |
| InChi: | InChI=1S/C19H21NO5S/c1-13-6-8-14(9-7-13)26(22,23)20-10-4-5-17(21)15-11-18(24-2)19(25-3)12-16(15)20/h6-9,11-12H,4-5,10H2,1-3H3 |
| InChiKey: | InChIKey=INHDQBAQIAULRS-UHFFFAOYSA-N |
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