basic_info |
|
| Product_Name: | OTAVA-FLUOR OTVD_0349 |
| EnglishSynonyms: | OTAVA-FLUOR OTVD_0349 |
| pro_mdlNumber: | MFCD10001297 |
| pro_acceptors: | 5 |
| pro_donors: | 0 |
| pro_smile: | Cc1c[n+](ccc1/C=C/c2ccc(cc2)N(C)C)CCCCS(=O)(=O)[O-] |
| InChi: | InChI=1S/C20H26N2O3S/c1-17-16-22(13-4-5-15-26(23,24)25)14-12-19(17)9-6-18-7-10-20(11-8-18)21(2)3/h6-12,14,16H,4-5,13,15H2,1-3H3 |
| InChiKey: | InChIKey=BSHFVLSEVJOPGV-UHFFFAOYSA-N |
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