basic_info |
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| Product_Name: | 1-AZETIDINECARBOXYLIC ACID, 3-[4-(METHYLSULFONYL)-1-PIPERAZINYL], 1,1-DIMETHYLETHYL ESTER |
| CAS: | 178312-23-7 |
| EnglishSynonyms: | 3-[4-(METHYLSULFONYL)-1-PIPERAZINYL]-1-AZETIDINECARBOXYLIC ACID 1,1-DIMETHYLETHYL ESTER ; TERT-BUTYL 3-(4-(METHYLSULFONYL)PIPERAZIN-1-YL)AZETIDINE-1-CARBOXYLATE ; 1-AZETIDINECARBOXYLIC ACID, 3-[4-(METHYLSULFONYL)-1-PIPERAZINYL], 1,1-DIMETHYLETHYL ESTER |
| pro_mdlNumber: | MFCD09264426 |
| pro_acceptors: | 7 |
| pro_donors: | 0 |
| pro_smile: | CC(C)(C)OC(=O)N1CC(C1)N2CCN(CC2)S(=O)(=O)C |
| InChi: | InChI=1S/C13H25N3O4S/c1-13(2,3)20-12(17)15-9-11(10-15)14-5-7-16(8-6-14)21(4,18)19/h11H,5-10H2,1-4H3 |
| InChiKey: | InChIKey=KQHMCDLKYDJVSB-UHFFFAOYSA-N |
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