18 19 0 0000 0 0 0 0 0999 V2000 6.3301 -1.9827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.4827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.4827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.0173 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 8.0901 -1.0174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.9962 -0.5035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.9962 0.5381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.0901 1.0520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.0785 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 2 16 1 0 2 17 1 0 3 16 2 0 4 6 1 0 4 10 1 0 4 12 1 0 5 10 2 0 5 14 1 0 5 15 1 0 6 7 1 0 6 11 1 0 7 8 1 0 8 9 1 0 9 10 1 0 12 13 1 0 13 14 2 0 13 16 1 0 17 18 1 0 M CHG 1 5 1 M END > 12 13 8 13 14 8 4 10 8 4 12 8 5 10 8 5 14 8 6 11 3 > InChI=1S/C13H19N2O3/c1-4-18-13(17)10-8-14(3)11-7-5-6-9(2)15(11)12(10)16/h8-9H,4-7H2,1-3H3/q+1 > JOWRFSPJFXLGGY-UHFFFAOYSA-N > 1/0/N:18,11,15,17,8,7,9,14,6,13,10,12,16,5,4,1,3,2/CRV:14+1/rA:37cOOONN+CCCCCCCCCCCCCHHHHHHHHHHHHHHHHHHH/rB:;;;;s4;s6;s7;s8;s4d5s9;s6;d1s4;s12;s5d13;s5;s2d3s13;s2;s17;s6;s7;s7;s8;s8;s9;s9;s11;s11;s11;s14;s15;s15;s15;s17;s17;s18;s18;s18;/rC:6.3301,-1.9827,0;3.7321,-.4827,0;4.5981,-1.9827,0;7.1962,-.4827,0;6.3301,1.0173,0;8.0901,-1.0174,0;8.9962,-.5035,0;8.9962,.5381,0;8.0901,1.052,0;7.1962,.5173,0;8.0785,-2.0173,0;6.3301,-.9827,0;5.4641,-.4827,0;5.4641,.5173,0;6.3301,2.0173,0;4.5981,-.9827,0;2.866,-.9827,0;2,-.4827,0;7.549,-1.3201,0;9.2052,-1.0872,0;9.607,-.3974,0;9.607,.432,0;9.2052,1.1218,0;8.4837,1.531,0;7.6855,1.5217,0;8.6985,-2.0245,0;8.0714,-2.6373,0;7.4586,-2.0101,0;4.9272,.8273,0;5.7101,2.0173,0;6.3301,2.6373,0;6.9501,2.0173,0;3.2646,-1.4577,0;2.4675,-1.4577,0;1.69,-1.0196,0;1.4631,-.1727,0;2.31,.0542,0; > C13 H19 N2 O3 > 251.3016 > O=C1C(C(=O)OC([H])([H])C([H])([H])[H])=C([H])[N+](C([H])([H])[H])=C2C([H])([H])C([H])([H])C([H])([H])C([H])(C([H])([H])[H])N21 > 64949 $$$$