basic_info |
|
| Product_Name: | OTAVA-FLUOR OTVD_0188 |
| EnglishSynonyms: | OTAVA-FLUOR OTVD_0188 |
| pro_mdlNumber: | MFCD10001150 |
| pro_acceptors: | 3 |
| pro_donors: | 0 |
| pro_smile: | CC1=CC(=Cc2[n+](c3ccccc3s2)C)C=C(N1CCCOC)C.[O-]Cl(=O)(=O)=O |
| InChi: | InChI=1S/C20H25N2OS.ClHO4/c1-15-12-17(13-16(2)22(15)10-7-11-23-4)14-20-21(3)18-8-5-6-9-19(18)24-20;2-1(3,4)5/h5-6,8-9,12-14H,7,10-11H2,1-4H3;(H,2,3,4,5)/q+1;/p-1 |
| InChiKey: | InChIKey=WWCYPEBOLQNLPV-UHFFFAOYSA-M |
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