0 B21R3.3945867 O=C1C(=O)c2ccccc2c3c1cc(cc3)[N+](=O)[O-] Amb1905620 [0,0,0,0,0,0|0,0,0]=0 1 B20R3.256646 OC(=O)c1cc2NC(=O)c3ccccc3-c2cc1 Amb24106325 [1,0,0,0,0,0|2,0,1]=4 2 B20R3.256646 [O-][N+](=O)c1cc2OC(=O)c3ccccc3-c2cc1 Amb20662457 [1,0,0,0,0,0|1,0,0]=2 3 B20R3.256646 [O-][N+](=O)c1ccc2c(c1)[nH]c(=O)c3ccccc23 Amb17943580 [1,0,0,0,0,0|1,0,0]=2 4 B20R3.4489689 [O-][N+](=O)c1cc2c(cc1)-c3ccccc3OC2=O Amb24309316 [1,0,0,0,0,0|1,0,0]=2 5 B20R3.4489689 [O-][N+](=O)c1cc2c(cc1)N3C=CC=CC3=NC2=O Amb19815621 [1,0,0,0,0,0|2,0,0]=3 6 B20R2.173688 O=C(C(=O)c1ccccc1)c2cccc(c2)C(=O)O Amb16203780 [0,0,1,0,0,0|1,0,1]=3 7 B19R2.8784 O=C(c1ccccc1)Cc2cccc(c2)[N+](=O)[O-] Amb10560132 [1,0,1,0,0,0|0,0,1]=3 8 B19R2.8784 O=C(c1cccnc1)Nc2cccc(c2)[N+](=O)[O-] Amb1017151 [1,0,1,0,0,0|2,0,0]=4 9 B19R2.8784 O=C(c1ccncc1)Oc2cccc(c2)[N+](=O)[O-] Amb226908 [1,0,1,0,0,0|2,0,0]=4 10 B19R2.8784 O=N(=Cc1cccc(c1)[N+](=O)[O-])c2ccccc2 Amb16200369 [1,0,1,0,0,0|1,0,0]=3 11 B19R2.8784 [O-]N(=O)c1cc(ccc1)NC(=O)c2ccccc2 Amb22280668 [1,0,1,0,0,0|1,0,1]=4 12 B19R2.8784 [O-][N+](=O)c1cccc(OC(=O)c2ccccc2)c1 Amb17843268 [1,0,1,0,0,0|1,0,0]=3 13 B19R2.8784 [O-]\[N+](=C/c1cccc(c1)[N+](=O)[O-])\c2ccccc2 Amb1148345 [1,0,1,0,0,0|1,0,1]=4 14 B19R2.8784 [O-]\[N+](=C\c1cccc(c1)[N+](=O)[O-])\c2ccccc2 Amb10069562 [1,0,1,0,0,0|1,0,1]=4 15 B19R2.8792 O=C(c1cccc(c1)[N+](=O)[O-])C[n+]2ccccc2 Amb2411931 [1,0,1,0,0,0|1,0,1]=4 16 B19R2.8792 O=C(c1cccc(c1)[N+](=O)[O-])Nc2ccccc2 Amb1233439 [1,0,1,0,0,0|1,0,0]=3 17 B19R2.8792 [O-][N+](=O)c1cc([n]cc1)C(=O)Nc2ccccc2 Amb24084988 [1,0,1,0,0,0|2,0,0]=4 18 B19R3.358 OC(=O)c1ccc2c(c1)ccc3c2cccc3 Amb16233110 [2,0,0,0,0,0|1,0,1]=4 19 B19R3.2463131 Clc1ccc2c(c1)C(=O)C(=O)c3c2cccc3 Amb17596719 [2,0,0,0,0,0|1,0,0]=3 20 B19R3.2463131 O=C1c2cc(Br)ccc2-c3ccccc3C1=O Amb22495557 [2,0,0,0,0,0|1,0,0]=3 21 B21R2.19031 O=C(N(c1ccccc1)C)c2ccc(c(c2)[N+](=O)[O-])F Amb135230 [0,1,1,0,0,0|2,0,0]=4 22 B21R2.107169 CN(C(=O)c1ccccc1C)c2cccc(c2)[N+](=O)[O-] Amb2477090 [0,1,1,0,0,0|2,0,0]=4 23 B21R2.380266 COC(=O)c1cccc(c1)C(=O)C(=O)c2ccccc2 Amb10574113 [0,1,1,0,0,0|1,0,1]=4 24 B21R2.2986 COc1cc(ccc1c2ccccc2C(=O)O)[N+](=O)[O-] Amb17136452 [0,1,1,0,0,0|2,0,0]=4 25 B21R3.43414 [O-][N+](=O)c1cccc2c1NN(c3ccccc3)C2=O Amb22475566 [0,0,1,1,0,0|2,0,0]=4 26 B21R3.26995996 [O-][N+](=O)c1cccc2c1-c3ccccc3C(=O)C2=O Amb22339949 [0,0,1,1,0,0|0,0,0]=2 27 B21R3.4977761 O=C1c2cc(ccc2C(=O)c3c1cccc3)[N+](=O)[O-] Amb2227695 [0,0,1,1,0,0|2,0,0]=4 28 B19R3.2545759 OC(=O)c1ccc2c(c1)C(=O)c3c2cccc3 Amb1240566 [1,0,0,0,1,0|1,0,1]=4 29 B21R2.20349 CNC(=O)c1cc(ccc1Sc2ccccc2)[N+](=O)[O-] Amb13891880 [0,0,1,0,0,1|2,0,0]=4 30 B21R2.20349 COC(=O)c1cc(ccc1Oc2ccccc2)[N+]([O-])=O Amb22432391 [0,0,1,0,0,1|2,0,0]=4 31 B21R2.379930 COC(=O)c1ccccc1Oc2ccc(cc2)[N+](=O)[O-] Amb192374 [0,0,1,0,0,1|2,0,0]=4 32 B21R2.12974 O=C(c1cccc(c1)[N+](=O)[O-])C[S+](c2ccccc2)C Amb10554998 [0,0,1,0,0,1|2,0,0]=4 33 B21R2.12974 O=C(c1cccc(c1)[N+](=O)[O-])NC(c2ccccc2)C Amb10776179 [0,0,1,0,0,1|1,0,1]=4 34 B21R2.12974 O=C(c1cccc(c1)[N+](=O)[O-])N[C@@H](c2ccccc2)C Amb1912329 [0,0,1,0,0,1|1,0,1]=4 35 B21R2.12976 CC(c1ccccc1)C(=O)Nc2cc(ccc2)[N+]([O-])=O Amb22371969 [0,0,1,0,0,1|1,0,1]=4 36 B21R2.12976 O=C(C(=O)c1ccccc1)Nc2cccc(c2)C(=O)C Amb17361654 [0,0,1,0,0,1|2,0,0]=4 37 B21R3.6806840 [O-][N+](=O)c1ccc2Nc3ncccc3C(=O)Nc2c1 Amb17779273 [1,0,0,0,0,1|2,0,0]=4 38 B21R3.1527350 COc1cc2c(cc1)Sc3ccccc3C(=O)C2=O Amb22000131 [1,0,0,0,0,1|2,0,0]=4 39 B21R3.6850795 [O-][N+](=O)c1cc2c(cc1)Sc3ccccc3CC2=O Amb22467184 [1,0,0,0,0,1|0,0,1]=3 40 B21R3.6850795 [O-][N+](=O)c1ccc2Nc3ccccc3NC(=O)c2c1 Amb17773023 [1,0,0,0,0,1|1,0,0]=3