15 14 0 0000 0 0 0 0 0999 V2000 2.2602 -0.6642 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 3.4595 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 5.7198 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 8.0446 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 4.5943 -2.0019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 6.9191 -2.0019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 2.2602 -2.0019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.4595 -1.3285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.7198 -1.3285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.1347 -1.3285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.2602 -3.3304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.0631 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.0019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.1347 -3.9946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 9.2255 -1.9558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 2 8 2 0 3 9 2 0 4 12 2 0 5 8 1 0 5 9 1 0 6 9 1 0 6 12 1 0 7 8 1 0 7 10 1 0 7 11 1 0 10 13 1 0 11 14 1 0 12 15 1 0 M END > InChI=1S/C9H15BrN2O3/c1-4-9(10,5-2)7(14)12-8(15)11-6(3)13/h4-5H2,1-3H3,(H2,11,12,13,14,15) > SAZUGELZHZOXHB-UHFFFAOYSA-N > 1/1/N:13,14,15,10,11,12,8,9,7,1,6,5,4,2,3/E:(1,2)(4,5)/rA:15nBrOOONNCCCCCCCCC/rB:;;;;;s1;d2s5s7;d3s5s6;s7;s7;d4s6;s10;s11;s12;/rC:2.2602,-.6642,0;3.4595,0,0;5.7198,0,0;8.0446,0,0;4.5943,-2.0019,0;6.9191,-2.0019,0;2.2602,-2.0019,0;3.4595,-1.3285,0;5.7198,-1.3285,0;1.1347,-1.3285,0;2.2602,-3.3304,0;8.0631,-1.31,0;0,-2.0019,0;1.1347,-3.9946,0;9.2255,-1.9558,0; > C9 H15 Br N2 O3 > 279.131 > BrC(CC)(CC)C(NC(NC(C)=O)=O)=O > 6244 $$$$