0 B11R1.21 CN1C=C(C(=O)O)C=CC1=O B039490 [1,0,0,0,0,0|1,0,1]=3 1 B11R1.266 COC1=CC(C(C)N)=CC=C1 B006176 [1,0,0,0,0,0|2,0,1]=4 2 B11R1.266 O=C(O)C1=CC(CBr)=CC=C1 B019567 [1,0,0,0,0,0|2,0,0]=3 3 B11R1.280 COC1=C(O)C=CC(C#N)=C1 B004154 [1,0,0,0,0,0|1,0,1]=3 4 B13R1.13 NC1=CC=C(C(=O)O)C=C1[N+](=O)[O-] B048530 [0,1,0,0,0,0|3,0,0]=4 5 B13R1.3091 COC1=C(OC)C=C(C(C)N)C=C1 B039340 [0,1,0,0,0,0|2,0,1]=4 6 B13R1.3091 COC1=CC=C(C(C)N)C=C1OC B006175 [0,1,0,0,0,0|2,0,1]=4 7 B13R2.430 CC(N)C1=CC2=C(C=C1)OCO2 B014647 [0,0,0,1,0,0|2,0,1]=4 8 B13R2.430 O=C(O)C1=CC2=NON=C2C=C1 B049718 [0,0,0,1,0,0|3,0,0]=4 9 B11R1.48 CCC1=C(Br)C=C(C(=O)O)S1 B013956 [0,0,0,0,1,0|3,0,0]=4 10 B11R1.64 CCC1=C(C)SC=C1C(=O)O B007493 [0,0,0,0,1,0|3,0,0]=4 11 B11R1.64 COC1=C(C(=O)O)SC=C1C B029962 [0,0,0,0,1,0|2,0,0]=3 12 B10R1.13 O=C(O)C1=CC=C(O)N=C1 B049653 [2,0,0,0,0,0|1,0,0]=3 13 B12R1.367 CC1=C(C)C=C(C(=O)NN)C=C1 B014932 [1,1,0,0,0,0|2,0,0]=4 14 B12R1.367 CC1=C(C)C=C(\C(C)=N\O)C=C1 B046365 [1,1,0,0,0,0|2,0,0]=4 15 B12R1.367 COC(=O)C1=CC(Br)=C(N)C=C1 B049028 [1,1,0,0,0,0|2,0,0]=4 16 B12R1.1005 NC1=CC(C(=O)O)=CC(N)=C1Cl B049388 [1,1,0,0,0,0|2,0,0]=4 17 B12R1.11 COC1=CC([N+](=O)[O-])=CC(N)=C1 B014360 [1,1,0,0,0,0|1,0,1]=4 18 B12R1.279 CCOC1=CC(C(C)=O)=CC=C1 B000300 [1,1,0,0,0,0|1,0,0]=3 19 B12R1.435 COC(=O)C1=CC=CC(CBr)=C1 B020237 [1,1,0,0,0,0|2,0,0]=4 20 B12R1.453 COC1=CC(C(=O)O)=C(Cl)C=C1 B037976 [1,1,0,0,0,0|0,0,0]=2 21 B12R1.78 COC1=CC=C(C=O)C=C1CCl B006541 [1,1,0,0,0,0|2,0,0]=4 22 B12R1.270 CCOC1=C(O)C=CC(C#N)=C1 B004190 [1,1,0,0,0,0|1,0,1]=4 23 B12R1.286 COC1=C(O)C=CC(\C=N\O)=C1 B004150 [1,1,0,0,0,0|0,0,0]=2 24 B12R1.300 COC1=C(O)C(Br)=CC(C#N)=C1 B004166 [1,1,0,0,0,0|1,0,1]=4 25 B12R1.300 COC1=C(O)C(Br)=CC(C=O)=C1 B004161 [1,1,0,0,0,0|0,0,0]=2 26 B12R1.300 COC1=C(O)C(Cl)=CC(C#N)=C1 B004160 [1,1,0,0,0,0|1,0,1]=4 27 B12R1.300 COC1=C(O)C(Cl)=CC(C=O)=C1 B004155 [1,1,0,0,0,0|0,0,0]=2 28 B12R1.300 COC1=C(O)C(I)=CC(C#N)=C1 B004184 [1,1,0,0,0,0|1,0,1]=4 29 B12R1.300 COC1=C(O)C(I)=CC(C=O)=C1 B004179 [1,1,0,0,0,0|0,0,0]=2 30 B12R1.449 COC1=C(O)C=C(Br)C(C=O)=C1 B004167 [1,1,0,0,0,0|0,0,0]=2 31 B12R1.622 COC1=COC(C(=O)O)=C1OC B048951 [0,1,0,0,1,0|1,0,0]=3 32 B12R2.44 NCC1=CC2=C(C=C1)OCO2 B019914 [1,0,0,1,0,0|1,0,1]=4 33 B14R2.781 CC(=O)C1=CC=C2OCCOC2=C1 B020249 [0,1,0,1,0,0|1,0,0]=3 34 B14R2.781 O=C(O)C1=CC=C2OCCOC2=C1 B013959 [0,1,0,1,0,0|0,0,0]=2 35 B14R2.624 O=[N+]([O-])C1=CC2=C(C=C1Br)OCO2 B049712 [0,1,0,1,0,0|1,0,1]=4 36 B10R1.58 CC1=C(Br)C=C(C(=O)O)S1 B029947 [1,0,0,0,1,0|2,0,0]=4 37 B10R1.194 CC1=C(C)C(C(=O)O)=CS1 B007490 [1,0,0,0,1,0|2,0,0]=4 38 B10R1.31 CCC1=CC=C(C(=O)O)S1 B000094 [1,0,0,0,1,0|2,0,0]=4 39 B10R1.31 COC1=NC=C(C(=O)O)S1 B059784 [1,0,0,0,1,0|2,0,0]=4 40 B14R1.42 COC1=C(O)C=CC(CCC(=O)O)=C1 B050847 [0,0,0,0,0,2|0,0,0]=2