"1" . "InChI=1S/C14H16N2O3S/c1-3-19-13(18)11-8(2)15-14(20)16-12(11)9-5-4-6-10(17)7-9/h4-7,12,17H,3H2,1-2H3,(H2,15,16,20)/t12-/m0/s1" . "340.132411154" . "OOOC1=C(Cl)C=C(NC2=CC=CC=C2C(O)=O)C=C1Cl" . "3.6" . "C41H38N6O5S2" . "InChIKey=GXHBCWCMYVTJOW-FHUHANJTSA-N" . "6.27" . "302.224580204" . "45.8" . "deoxy-bigchap" . "ALOGPS" . "C12H15N5O4" . "12.4" . "-1" . "ChemAxon" . "2.73" . "2" . "C3H5N3O9" .