"ALOGPS" . "9" . "1.57e-01 g/l" . "4-benzoyl-3-nitrobenzene-1,2-diol" . "9.33" . "-4.9" . "0" . "45.84" . "6.59e-01 g/l" . "ChemAxon" . "4.32" . "381.898" . "1" . "InChI=1S/C21H32N2O9S/c1-6-30-17(24)21(18(25)31-7-2,12-13-22-19(26)32-20(3,4)5)14-15-8-10-16(11-9-15)23-33(27,28)29/h8-11,23H,6-7,12-14H2,1-5H3,(H,22,26)(H,27,28,29)" . "NC(=[NH2+])C1=CC2=C(N\\C(N2)=C2/C=CC=CC2=O)C=C1" . "3.39" . "3.84e-02 g/l" . "99.83" . "InChIKey=JSSVIGGKHIJEHO-UHFFFAOYSA-N" .