basic_info |
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| Product_Name: | 1,1'-(M-PHENYLENEBIS(OXY(2-HYDROXYTRIMETHYLENE)))BIS(1-BENZYLPIPERIDINIUM CHLORIDE) |
| CAS: | 105730-57-2 |
| EnglishSynonyms: | 1,1'-(M-PHENYLENEBIS(OXY(2-HYDROXYTRIMETHYLENE)))BIS(1-BENZYLPIPERIDINIUM CHLORIDE) |
| pro_mdlNumber: | MFCD01699646 |
| pro_acceptors: | 6 |
| pro_donors: | 2 |
| pro_smile: | c1ccc(cc1)C[N+]2(CCCCC2)CC(COc3cccc(c3)OCC(C[N+]4(CCCCC4)Cc5ccccc5)O)O.[Cl-].[Cl-] |
| InChi: | InChI=1S/C36H50N2O4.2ClH/c39-33(27-37(20-9-3-10-21-37)25-31-14-5-1-6-15-31)29-41-35-18-13-19-36(24-35)42-30-34(40)28-38(22-11-4-12-23-38)26-32-16-7-2-8-17-32;;/h1-2,5-8,13-19,24,33-34,39-40H,3-4,9-12,20-23,25-30H2;2*1H/q+2;;/p-2 |
| InChiKey: | InChIKey=DTUPRDSMMNGURO-UHFFFAOYSA-L |
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