basic_info |
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Product_Name: | 2-[(4-METHYLPHENYL)(METHYLSULFONYL)AMINO]BUTANOIC ACID |
EnglishSynonyms: | 2-[(4-METHYLPHENYL)(METHYLSULFONYL)AMINO]BUTANOIC ACID ; 2-[N-(4-METHYLPHENYL)METHANESULFONAMIDO]BUTANOIC ACID |
pro_mdlNumber: | MFCD18170145 |
pro_acceptors: | 5 |
pro_donors: | 1 |
pro_smile: | CCC(C(=O)O)N(c1ccc(cc1)C)S(=O)(=O)C |
InChi: | InChI=1S/C12H17NO4S/c1-4-11(12(14)15)13(18(3,16)17)10-7-5-9(2)6-8-10/h5-8,11H,4H2,1-3H3,(H,14,15) |
InChiKey: | InChIKey=BTMDVCIJJNFLPG-UHFFFAOYSA-N |
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