basic_info |
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| Product_Name: | 2-([5,6-BIS(NITROXY)HEXANOYL]OXY)BENZOIC ACID |
| EnglishSynonyms: | COMPOUND NO 53 ; 2-([5,6-BIS(NITROXY)HEXANOYL]OXY)BENZOIC ACID |
| pro_mdlNumber: | MFCD12912168 |
| pro_acceptors: | 14 |
| pro_donors: | 1 |
| pro_smile: | c1cc(c(c(c1)OC(=O)CCCCCO[N+](=O)[O-])OC(=O)CCCCCO[N+](=O)[O-])C(=O)O |
| InChi: | InChI=1S/C19H24N2O12/c22-16(10-3-1-5-12-30-20(26)27)32-15-9-7-8-14(19(24)25)18(15)33-17(23)11-4-2-6-13-31-21(28)29/h7-9H,1-6,10-13H2,(H,24,25) |
| InChiKey: | InChIKey=LBVMXQITKLKHNT-UHFFFAOYSA-N |
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