OTAVA-FLUOR OTVD_0189

pro_cas
pro_cdbregno
CCD00911643
pro_formula
C28 H33 N2 O S . Cl O4
pro_molWeight
545.097

basic_info

Product_Name: OTAVA-FLUOR OTVD_0189
EnglishSynonyms: OTAVA-FLUOR OTVD_0189
pro_mdlNumber: MFCD10001151
pro_acceptors: 3
pro_donors: 0
pro_smile: CCCCCCOc1ccc(cc1)N2C(=CC(=Cc3[n+](c4ccccc4s3)C)C=C2C)C.[O-]Cl(=O)(=O)=O
InChi: InChI=1S/C28H33N2OS.ClHO4/c1-5-6-7-10-17-31-25-15-13-24(14-16-25)30-21(2)18-23(19-22(30)3)20-28-29(4)26-11-8-9-12-27(26)32-28;2-1(3,4)5/h8-9,11-16,18-20H,5-7,10,17H2,1-4H3;(H,2,3,4,5)/q+1;/p-1
InChiKey: InChIKey=VQGZOSQUOJPEKJ-UHFFFAOYSA-M

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