basic_info |
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| Product_Name: | N-(7-NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)TAURINE SODIUM SALT |
| CAS: | 129650-41-5 |
| EnglishSynonyms: | NBD-TAURINE SODIUM SALT ; N-(7-NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)TAURINE SODIUM SALT |
| pro_mdlNumber: | MFCD00133553 |
| pro_acceptors: | 10 |
| pro_donors: | 1 |
| pro_smile: | c1cc(c2c(c1NCCS(=O)(=O)[O-])non2)[N+](=O)[O-].[Na+] |
| InChi: | InChI=1S/C8H8N4O6S.Na/c13-12(14)6-2-1-5(7-8(6)11-18-10-7)9-3-4-19(15,16)17;/h1-2,9H,3-4H2,(H,15,16,17);/q;+1/p-1 |
| InChiKey: | InChIKey=YKWYDEQGUFIFOQ-UHFFFAOYSA-M |
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