13 14 0 0000 0 0 0 0 0999 V2000 1.1495 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 1.1495 -1.3331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.9956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 2.2990 -1.9956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.2990 -3.3287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.4564 -3.9913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.6059 -3.3287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.8751 -3.7358 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 6.6494 -2.6582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 7.9825 -2.6582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 5.8751 -1.5885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.6059 -1.9956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.4564 -1.3331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 4 13 2 0 5 6 2 0 6 7 1 0 7 8 1 0 7 12 2 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 M END > InChI=1S/C9H7NO3/c11-8-4-6-3-5(9(12)13)1-2-7(6)10-8/h1-3H,4H2,(H,10,11)(H,12,13) > LLLKBUWXODIMEW-UHFFFAOYSA-N > 1/1/N:5,6,13,11,4,12,7,9,2,8,10,1,3/E:(12,13)/rA:13nOCOCCCCNCOCCC/rB:s1;d2;s2;s4;d5;s6;s7;s8;d9;s9;d7s11;d4s12;/rC:1.1495,0,0;1.1495,-1.3331,0;0,-1.9956,0;2.299,-1.9956,0;2.299,-3.3287,0;3.4564,-3.9913,0;4.6059,-3.3287,0;5.8751,-3.7358,0;6.6494,-2.6582,0;7.9825,-2.6582,0;5.8751,-1.5885,0;4.6059,-1.9956,0;3.4564,-1.3331,0; > C9 H7 N O3 > 177.1568 > OC(C1=CC2CC(=O)NC=2C=C1)=O > 2053739 $$$$