basic_info |
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Product_Name: | 4-CHLORO-A-[2-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]ETHYL]-BENZENEACETIC ACID |
CAS: | 853680-02-1 |
EnglishSynonyms: | 4-CHLORO-A-[2-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]ETHYL]-BENZENEACETIC ACID |
pro_mdlNumber: | MFCD08456681 |
pro_acceptors: | 5 |
pro_donors: | 2 |
pro_smile: | CC(C)(C)OC(=O)NCCC(c1ccc(cc1)Cl)C(=O)O |
InChi: | InChI=1S/C15H20ClNO4/c1-15(2,3)21-14(20)17-9-8-12(13(18)19)10-4-6-11(16)7-5-10/h4-7,12H,8-9H2,1-3H3,(H,17,20)(H,18,19) |
InChiKey: | InChIKey=VXGQKJRLFCEUEN-UHFFFAOYSA-N |
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