basic_info |
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| Product_Name: | 4-噁唑羧酸,5-(3-溴苯基)-,乙基酯 |
| CAS: | 104123-86-6 |
| 中文同义词: | 4-噁唑羧酸,5-(3-溴苯基)-,乙基酯 |
| EnglishSynonyms: | 3-((DIBUTYLAMINO)METHYL)-5-CINNAMYLIDENE-2-(PHENYLIMINO)-4-THIAZOLIDIN ONE |
| pro_mdlNumber: | MFCD01680991 |
| pro_acceptors: | 4 |
| pro_donors: | 0 |
| pro_smile: | CCCCN(CCCC)CN\1C(=O)/C(=C\C=C\c2ccccc2)/S/C1=N/c3ccccc3 |
| InChi: | InChI=1S/C27H33N3OS/c1-3-5-20-29(21-6-4-2)22-30-26(31)25(19-13-16-23-14-9-7-10-15-23)32-27(30)28-24-17-11-8-12-18-24/h7-19H,3-6,20-22H2,1-2H3/b16-13+,25-19+,28-27+ |
| InChiKey: | InChIKey=VZCYVBBKKJLBOR-QQIGNQNBSA-N |
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