basic_info |
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| Product_Name： | 2(3H)-ISOTHIAZOLEACETIC ACID, ALPHA-[[4-(1,1-DIMETHYLETHOXY)PHENYL] METHYL]-, METHYL ESTER, 1,1-DIOXIDE, (ALPHAS) |
| CAS： | 515130-13-9 |
| EnglishSynonyms： | 2(3H)-ISOTHIAZOLEACETIC ACID, ALPHA-[[4-(1,1-DIMETHYLETHOXY)PHENYL] METHYL]-, METHYL ESTER, 1,1-DIOXIDE, (ALPHAS) |
| pro_mdlNumber： | MFCD08460306 |
| pro_acceptors： | 6 |
| pro_donors： | 0 |
| pro_smile： | CC(C)(C)Oc1ccc(cc1)C[C@@H](C(=O)OC)N2CC=CS2(=O)=O |
| InChi： | InChI=1S/C17H23NO5S/c1-17(2,3)23-14-8-6-13(7-9-14)12-15(16(19)22-4)18-10-5-11-24(18,20)21/h5-9,11,15H,10,12H2,1-4H3/t15-/m0/s1 |
| InChiKey： | InChIKey=HNNGQVQIXOEUJT-HNNXBMFYSA-N |
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English![2(3H)-ISOTHIAZOLEACETIC ACID, ALPHA-[[4-(1,1-DIMETHYLETHOXY)PHENYL] METHYL]-, METHYL ESTER, 1,1-DIOXIDE, (ALPHAS)](http://www.chemcd.com/createImage?smile=CC%28C%29%28C%29Oc1ccc%28cc1%29C%5BC%40%40H%5D%28C%28%3DO%29OC%29N2CC%3DCS2%28%3DO%29%3DO&size=web.jpg)