14 15 0 0000 0 0 0 0 0999 V2000 3.7891 1.8184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 5.4071 1.8184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7694 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 2.0000 -1.2694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7694 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 4.5981 1.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.0981 2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.0981 2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 1 8 1 0 2 6 1 0 2 9 1 0 3 5 1 0 4 5 2 0 5 12 1 0 6 7 1 0 7 10 2 0 7 11 1 0 8 9 1 0 10 12 1 0 11 13 2 0 12 14 2 0 13 14 1 0 M CHG 2 3 -1 5 1 M END > 10 12 8 11 13 8 12 14 8 13 14 8 7 10 8 7 11 8 > InChI=1S/C9H9NO4/c11-10(12)8-3-1-2-7(6-8)9-13-4-5-14-9/h1-3,6,9H,4-5H2 > YOGPCAYIEHLIMG-UHFFFAOYSA-N > 1/0/N:13,11,14,8,9,10,7,12,6,5,3,4,1,2/E:(4,5)(11,12)(13,14)/CRV:10.5/rA:23nOOO-ON+CCCCCCCCCHHHHHHHHH/rB:;;;s3d4;s1s2;s6;s1;s2s8;d7;s7;s5s10;d11;d12s13;s6;s8;s8;s9;s9;s10;s11;s13;s14;/rC:3.7891,1.8184,0;5.4071,1.8184,0;2.866,-2.7694,0;2,-1.2694,0;2.866,-1.7694,0;4.5981,1.2306,0;4.5981,.2306,0;4.0981,2.7694,0;5.0981,2.7694,0;3.7321,-.2694,0;5.4641,-.2694,0;3.7321,-1.2694,0;5.4641,-1.2694,0;4.5981,-1.7694,0;5.1505,.9491,0;4.1629,3.386,0;3.4916,2.8983,0;5.7045,2.8983,0;5.0333,3.386,0;3.1951,.0406,0;6.001,.0406,0;6.001,-1.5794,0;4.5981,-2.3894,0; > C9 H9 N O4 > 195.1721 > O1C([H])([H])C([H])([H])OC1([H])C1C([H])=C([H])C([H])=C(C=1[H])[N+](=O)[O-] > 210238 $$$$