basic_info |
|
| Product_Name： | ALDRICH-CPR S116602-1EA |
| CAS： | 28795-94-0 |
| EnglishSynonyms： | ALDRICH-CPR S116602-1EA ; ALDRICH-CPR S309958-1EA |
| pro_mdlNumber： | MFCD02727637 |
| pro_acceptors： | 6 |
| pro_donors： | 1 |
| pro_smile： | C[C@H](c1ccccc1)C(c2ccccc2)Oc3c(cccc3[N+](=O)[O-])C(=O)O |
| InChi： | InChI=1S/C22H19NO5/c1-15(16-9-4-2-5-10-16)20(17-11-6-3-7-12-17)28-21-18(22(24)25)13-8-14-19(21)23(26)27/h2-15,20H,1H3,(H,24,25)/t15-,20?/m1/s1 |
| InChiKey： | InChIKey=KBTHVBLDLJBSKM-IWPPFLRJSA-N |
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