3033 Marvin 12300703363D 30 31 0 0 0 0 999 V2000 2.4546 -2.8053 -0.5822 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0672 1.4256 2.1195 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.7014 -2.1438 -2.3854 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7632 -0.5528 -3.3231 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -0.1922 -0.5289 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0928 0.7815 -0.9583 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3245 0.8511 -0.8638 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8451 -0.5103 -0.9626 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2575 -0.6844 0.7062 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8059 2.0018 -1.0436 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0002 2.0820 -1.0131 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1376 3.2388 -1.0885 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2668 3.2760 -1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9264 -1.9371 0.7807 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8579 -0.0683 1.9341 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1066 -1.0777 -2.2733 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 -2.5453 2.0263 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1187 -0.6924 3.1704 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7817 -1.9250 3.2173 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8023 -0.3844 -0.4497 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3171 -1.2669 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4937 -0.6226 -1.2392 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8288 2.0063 -1.0626 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0236 2.1275 -1.0092 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6706 4.1108 -1.1104 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7555 4.1720 -1.1672 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6670 -3.4455 2.0904 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8366 -0.2663 4.0584 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9689 -2.3667 4.1202 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9774 -2.5864 -1.6761 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 2 15 1 0 0 0 0 3 16 1 0 0 0 0 3 30 1 0 0 0 0 4 16 2 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 2 0 0 0 0 7 11 2 0 0 0 0 8 16 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 12 1 0 0 0 0 10 23 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 26 1 0 0 0 0 14 17 1 0 0 0 0 15 18 2 0 0 0 0 17 19 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 29 1 0 0 0 0 M END > 10 12 8 11 13 8 12 13 8 14 17 8 15 18 8 17 19 8 18 19 8 6 10 8 6 7 8 7 11 8 9 14 8 9 15 8 > InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19) > DCOPUUMXTXDBNB-UHFFFAOYSA-N > 1/1/N:12,13,19,10,17,18,11,8,6,14,15,7,16,9,1,2,5,3,4/E:(5,6)(10,11)(15,16)(18,19)/rA:30nClClOONCCCCCCCCCCCCCCHHHHHHHHHHH/rB:;;;;;s5s6;s6;s5;d6;d7;s10;s11d12;s1d9;s2s9;s3d4s8;s14;d15;d17s18;s8;s8;s5;s10;s11;s12;s13;s17;s18;s19;s3;/rC:2.4546,-2.8053,-.5822;.0672,1.4256,2.1195;-2.7014,-2.1438,-2.3854;-1.7632,-.5528,-3.3231;1.063,-.1922,-.5289;-1.0928,.7815,-.9583;.3245,.8511,-.8638;-1.8451,-.5103,-.9626;1.2575,-.6844,.7062;-1.8059,2.0018,-1.0436;1.0002,2.082,-1.0131;-1.1376,3.2388,-1.0885;.2668,3.276,-1.107;1.9264,-1.9371,.7807;.8579,-.0683,1.9341;-2.1066,-1.0777,-2.2733;2.185,-2.5453,2.0263;1.1187,-.6924,3.1704;1.7817,-1.925,3.2173;-2.8023,-.3844,-.4497;-1.3171,-1.2669,-.379;1.4937,-.6226,-1.2392;-2.8288,2.0063,-1.0626;2.0236,2.1275,-1.0092;-1.6706,4.1108,-1.1104;.7555,4.172,-1.1672;2.667,-3.4455,2.0904;.8366,-.2663,4.0584;1.9689,-2.3667,4.1202;-2.9774,-2.5864,-1.6761; > C14 H11 Cl2 N O2 > 296.1487 > ClC1C([H])=C([H])C([H])=C(C=1N([H])C1=C([H])C([H])=C([H])C([H])=C1C([H])([H])C(=O)O[H])Cl > 2925 $$$$