basic_info |
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Product_Name: | N-(4-ETHYLPHENYL)-N-(METHYLSULFONYL)ALANINE |
EnglishSynonyms: | N-(4-ETHYLPHENYL)-N-(METHYLSULFONYL)ALANINE ; 2-[N-(4-ETHYLPHENYL)METHANESULFONAMIDO]PROPANOIC ACID |
pro_mdlNumber: | MFCD13032121 |
pro_acceptors: | 5 |
pro_donors: | 1 |
pro_smile: | CCc1ccc(cc1)N(C(C)C(=O)O)S(=O)(=O)C |
InChi: | InChI=1S/C12H17NO4S/c1-4-10-5-7-11(8-6-10)13(18(3,16)17)9(2)12(14)15/h5-9H,4H2,1-3H3,(H,14,15) |
InChiKey: | InChIKey=RSXCSSQWKDLMMF-UHFFFAOYSA-N |
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