0 B12R1.78 [C-]#[N+]C1=C(OC)C=C(OC)C=C1 4637-1-5P [0,0,0,0,0,0|3,0,1]=4 1 B11R1.37 C#CC1=C(OC)C=CC(N)=C1 4956-1-0B [1,0,0,0,0,0|2,0,1]=4 2 B11R1.37 C=CC1=C(OC)C=CC(N)=C1 4956-1-0A [1,0,0,0,0,0|2,0,1]=4 3 B11R1.37 COC1=CC(N)=CN=C1OC 4H56-1-XS [1,0,0,0,0,0|2,0,0]=3 4 B11R1.37 COC1=CC=C(O)C=C1C=O 2620-1-59 [1,0,0,0,0,0|2,0,1]=4 5 B11R1.279 CC1=CC(C=O)=CC=C1C#N 4737-1-0W [1,0,0,0,0,0|2,0,0]=3 6 B11R1.279 COC1=CC=C(C#N)C=C1C 4737-1-0Q [1,0,0,0,0,0|1,0,1]=3 7 B11R1.279 COC1=CC=C(C=O)N=C1Br 4H56-9-L2 [1,0,0,0,0,0|2,0,0]=3 8 B11R1.279 COC1=CC=C(CN)C=C1Br 4656-9-50 [1,0,0,0,0,0|2,0,1]=4 9 B11R1.279 COC1=CC=C(CO)C=C1O 2607-1-24 [1,0,0,0,0,0|0,0,2]=3 10 B11R1.280 CNC1=CC(C#N)=CC=C1O 4637-1-4K [1,0,0,0,0,0|2,0,1]=4 11 B11R1.280 COC1=C(F)C=CC(CN)=C1 4656-3-BW [1,0,0,0,0,0|2,0,1]=4 12 B11R1.280 N#CC1=CC(C=O)=CC=C1N 4637-1-48 [1,0,0,0,0,0|3,0,0]=4 13 B13R1.2422 COC1=C(O)C(OC)=C(OC)C=C1 2608-1-1E [0,1,0,0,0,0|2,0,0]=3 14 B13R1.2430 COC1=CC=C(C=O)C=C1C(C)C 2715-1-59 [0,1,0,0,0,0|1,0,0]=2 15 B13R1.3091 C#CC1=C(OC)C=C([N+](=O)[O-])C=C1 4954-1-0A [0,1,0,0,0,0|2,0,1]=4 16 B13R1.3091 CCC1=CC(C(C)=O)=CC=C1CO 2717-1-0U [0,1,0,0,0,0|3,0,0]=4 17 B13R1.3091 COC1=CC(B(O)O)=CN=C1OC 8H60-1-NK [0,1,0,0,0,0|2,0,1]=4 18 B13R1.3091 COC1=CC=C(C(=O)O)C=C1C#N 4637-1-3H [0,1,0,0,0,0|2,0,0]=3 19 B13R2.57 O=CC1=CC2=C(C=N1)OCCO2 4H56-1-312 [0,0,0,1,0,0|1,0,0]=2 20 B13R2.57 OCC1=CC2=C(C=C1)OCCN2 4H01-1-8U [0,0,0,1,0,0|1,0,2]=4 21 B10R1.25 COC1=CN=C(Br)C=C1O 4H56-9-X1 [2,0,0,0,0,0|2,0,0]=4 22 B10R1.25 COC1=NC=C(Cl)C=C1C 4H07-5-2Q [2,0,0,0,0,0|2,0,0]=4 23 B10R1.25 CSC1=CC=C(F)C=C1O 6666-3-0B [2,0,0,0,0,0|1,1,0]=4 24 B10R1.30 COC1=CC(O)=CC=C1C 2707-1-1N [2,0,0,0,0,0|0,0,1]=3 25 B10R1.3 COC1=CN=C(C=O)N=C1 4H56-1-0A [2,0,0,0,0,0|2,0,0]=4 26 B10R1.176 CC1=CC(C=O)=CN=C1O 4H56-1-0NL [2,0,0,0,0,0|1,0,0]=3 27 B10R1.176 NC1=CC(C=O)=CC=C1F 4630-3-0R [2,0,0,0,0,0|2,0,0]=4 28 B10R1.176 O=CC1=CC(Br)=C(O)N=C1 4H15-9-0K [2,0,0,0,0,0|2,0,0]=4 29 B10R1.176 O=CC1=CC(I)=C(O)N=C1 4H15-H-08 [2,0,0,0,0,0|2,0,0]=4 30 B10R1.172 C=CC1=CC(OC)=CC=N1 4H07-1-1W [2,0,0,0,0,0|2,0,0]=4 31 B12R1.112 CCOC1=CC=C(O)C=C1OC 2608-1-0T [1,1,0,0,0,0|0,0,1]=3 32 B12R1.112 COC1=CC(F)=CC=C1CCBr 2707-B-48 [1,1,0,0,0,0|2,0,0]=4 33 B12R1.234 COC1=C(OC)C(Cl)=CC(O)=C1 2608-5-0D [1,1,0,0,0,0|0,0,1]=3 34 B12R1.268 CCOC1=CC(O)=CC=C1OC 2608-1-0W [1,1,0,0,0,0|0,0,1]=3 35 B12R1.448 COC1=CC(N)=C(N)C=C1OC 4656-1-10 [1,1,0,0,0,0|1,0,0]=3 36 B12R1.48 CC(=O)C1=CC=C(C#N)C(C)=C1 4737-1-1B [1,1,0,0,0,0|2,0,0]=4 37 B12R1.48 COC1=C(Br)C=C(C(=O)Cl)C=C1 2616-D-04 [1,1,0,0,0,0|1,0,0]=3 38 B12R1.48 COC1=C(C)C=C(C(N)=O)C=C1 4748-1-1C [1,1,0,0,0,0|0,0,0]=2 39 B12R1.48 COC1=CC=C([N+](=O)[O-])N=C1C 4H54-1-FH [1,1,0,0,0,0|2,0,0]=4 40 B12R1.114 CCOC1=C(O)C=C(OC)C=C1 2608-1-1B [1,1,0,0,0,0|2,0,0]=4 41 B12R1.288 C=CCC1=CC=C(OC)C(F)=C1 2907-3-12 [1,1,0,0,0,0|2,0,0]=4 42 B12R1.288 COC1=C(Cl)C=C(\C=N\O)C=C1 4647-5-E1 [1,1,0,0,0,0|1,0,1]=4 43 B12R1.450 COC1=CC(Br)=C(OC)C=C1O 2608-9-09 [1,1,0,0,0,0|2,0,0]=4 44 B12R1.450 O=CC1=CC(O)=C(C=O)C=C1O 2615-1-57 [1,1,0,0,0,0|2,0,0]=4 45 B12R1.452 CC1=CC(C=O)=CN=C1N(C)C 4H56-1-0DV [1,1,0,0,0,0|2,0,0]=4 46 B12R1.653 COC1=C(C)C(N)=C(C#N)C=C1 4756-1-1V [1,1,0,0,0,0|1,0,1]=4 47 B12R1.653 COC1=CC=C(OC)C(C)=C1C 2707-1-0P [1,1,0,0,0,0|2,0,0]=4 48 B12R1.56 CC1=CC=C(C(=O)O)C=C1C=O 2721-1-1Y [1,1,0,0,0,0|2,0,0]=4 49 B12R1.56 COC1=CC(C(C)=O)=CC=C1Br 2617-9-37 [1,1,0,0,0,0|1,0,0]=3 50 B12R1.56 O=CC1=CC(C(=O)O)=CC=C1O 2629-1-0U [1,1,0,0,0,0|2,0,0]=4 51 B12R1.270 CCOC1=CC(C=O)=CC=C1Br 2615-9-31 [1,1,0,0,0,0|1,0,0]=3 52 B12R1.270 CCOC1=CC(C=O)=CC=C1F 2615-3-1R [1,1,0,0,0,0|1,0,0]=3 53 B12R1.449 COC1=CC(C=O)=C(F)C=C1Cl 2615-7-0L [1,1,0,0,0,0|1,0,0]=3 54 B12R1.654 COC1=C(O)C=CC(C=O)=C1Cl 2615-5-0E [1,1,0,0,0,0|0,0,0]=2 55 B14R1.2334 COC(=O)C1=CC=C(C=O)C=C1OC 2623-1-79 [0,2,0,0,0,0|0,0,0]=2 56 B14R1.1864 COC(=O)C1=CC=C(C=O)C(OC)=C1 2H23-1-0W [0,2,0,0,0,0|2,0,0]=4 57 B14R1.1864 COC1=CC=C(C(=O)CN)C=C1OC 4656-5-0M [0,2,0,0,0,0|0,0,0]=2 58 B14R1.14946 COC1=CC(N)=C(CC#N)C=C1OC 4637-1-3W [0,2,0,0,0,0|1,0,1]=4 59 B14R1.564 COC1=C(O)C=C(C=O)C=C1[N+](=O)[O-] 4654-1-8P [0,2,0,0,0,0|2,0,0]=4 60 B14R1.1355 COC1=C(OCC#N)C=CC(C=O)=C1 4637-1-6F [0,2,0,0,0,0|0,0,0]=2 61 B14R1.6723 CCOC1=CC=C(C(=O)O)C=C1C#N 4637-1-3G [0,2,0,0,0,0|2,0,0]=4 62 B14R1.1851 COC1=C(OC)C=C(C(C)=O)C(F)=C1 2617-3-0Y [0,2,0,0,0,0|0,0,0]=2 63 B12R2.24 ClC1=CC=C2OCCNC2=C1 4H21-5-24 [1,0,0,1,0,0|2,0,0]=4 64 B12R2.24 OC1=CC=C2OCCSC2=C1 6H01-1-0E [1,0,0,1,0,0|0,1,1]=4 65 B12R2.44 O=CC1=CC2=C(C=C1)COC2 2H15-1-0P [1,0,0,1,0,0|2,0,0]=4 66 B12R2.44 O=CC1=CC=C2C=COC2=C1 2H15-1-31 [1,0,0,1,0,0|1,0,1]=4 67 B14R2.134 O=CC1=CC2=C(C=C1)OCC(=O)N2 4H48-1-092 [0,1,0,1,0,0|1,0,1]=4 68 B14R2.112 CNCC1=CC2=C(C=C1)OCCO2 4H31-1-1Z [0,1,0,1,0,0|1,0,1]=4 69 B14R2.781 NC(=O)C1=CC2=C(C=C1)OCCO2 4H48-1-09K [0,1,0,1,0,0|0,0,0]=2 70 B14R2.781 O=C(O)C1=CC=C2NCCOC2=C1 4H58-1-WF [0,1,0,1,0,0|1,0,0]=3 71 B14R2.781 O=C(O)C1=CC=C2OCCNC2=C1 4H58-1-FZ [0,1,0,1,0,0|1,0,0]=3 72 B14R2.24358 CC1=COC2=CC=C(C(=O)O)C=C12 2H21-1-0N [0,1,0,1,0,0|1,0,1]=4