basic_info |
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| Product_Name: | ETHYL 2-[(TERT-BUTOXYCARBONYL)AMINO]-3-[(4-NITROBENZYL)SULFANYL]PROPANOATE |
| EnglishSynonyms: | ETHYL 2-[(TERT-BUTOXYCARBONYL)AMINO]-3-[(4-NITROBENZYL)SULFANYL]PROPANOATE |
| pro_mdlNumber: | MFCD02082021 |
| pro_acceptors: | 8 |
| pro_donors: | 1 |
| pro_smile: | CCOC(=O)C(CSCc1ccc(cc1)[N+](=O)[O-])NC(=O)OC(C)(C)C |
| InChi: | InChI=1S/C17H24N2O6S/c1-5-24-15(20)14(18-16(21)25-17(2,3)4)11-26-10-12-6-8-13(9-7-12)19(22)23/h6-9,14H,5,10-11H2,1-4H3,(H,18,21) |
| InChiKey: | InChIKey=CYCMJAXGJGLQCZ-UHFFFAOYSA-N |
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