OTAVA-FLUOR OTVD_0191

pro_cas
pro_cdbregno
CCD00911645
pro_formula
C22 H29 N2 O S . Cl O4
pro_molWeight
468.999

basic_info

Product_Name: OTAVA-FLUOR OTVD_0191
EnglishSynonyms: OTAVA-FLUOR OTVD_0191
pro_mdlNumber: MFCD10001153
pro_acceptors: 3
pro_donors: 1
pro_smile: CC1=CC(=Cc2[n+](c3ccccc3s2)C)C=C(N1CCCCCCO)C.[O-]Cl(=O)(=O)=O
InChi: InChI=1S/C22H29N2OS.ClHO4/c1-17-14-19(15-18(2)24(17)12-8-4-5-9-13-25)16-22-23(3)20-10-6-7-11-21(20)26-22;2-1(3,4)5/h6-7,10-11,14-16,25H,4-5,8-9,12-13H2,1-3H3;(H,2,3,4,5)/q+1;/p-1
InChiKey: InChIKey=XRSDIOIYYAAVMM-UHFFFAOYSA-M

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