basic_info |
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Product_Name: | [1-(4-CARBOXY-PHENYL)-PYRROLIDIN-3-YL]-CARBAMIC ACID TERT-BUTYL ESTER |
CAS: | 953435-49-9 |
EnglishSynonyms: | [1-(4-CARBOXY-PHENYL)-PYRROLIDIN-3-YL]-CARBAMIC ACID TERT-BUTYL ESTER |
pro_mdlNumber: | MFCD06657322 |
pro_acceptors: | 6 |
pro_donors: | 2 |
pro_smile: | CC(C)(C)OC(=O)NC1CCN(C1)c2ccc(cc2)C(=O)O |
InChi: | InChI=1S/C16H22N2O4/c1-16(2,3)22-15(21)17-12-8-9-18(10-12)13-6-4-11(5-7-13)14(19)20/h4-7,12H,8-10H2,1-3H3,(H,17,21)(H,19,20) |
InChiKey: | InChIKey=QJBKEMOLZCNEGH-UHFFFAOYSA-N |
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