3380 -OEChem-04262401302D 35 37 0 0 0 0 0 0 0999 V2000 5.5096 0.7381 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.6577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9123 -0.4474 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.0405 1.0492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5984 -2.0984 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6235 -0.0740 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0444 0.0492 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3802 -0.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3802 -1.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5984 0.1486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2742 0.0597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1896 -0.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2742 -2.0096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6235 -1.8759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8209 1.1235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1803 -0.4541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1803 -1.4957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8209 -3.0734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7765 1.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0879 1.8037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9990 2.3932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3104 2.7786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 3.0734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 0.6797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7049 -0.5884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7049 -1.3615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2670 -2.6296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 -1.8078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2165 -3.2113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9589 -3.6778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4254 -2.9354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4954 1.6209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5915 2.5759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8559 3.2003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4039 3.6778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 14 2 0 0 0 0 3 7 1 0 0 0 0 4 7 2 0 0 0 0 5 9 1 0 0 0 0 5 14 1 0 0 0 0 5 18 1 0 0 0 0 6 10 2 0 0 0 0 6 12 1 0 0 0 0 7 16 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 9 13 1 0 0 0 0 10 15 1 0 0 0 0 11 16 2 0 0 0 0 11 24 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 13 17 2 0 0 0 0 13 27 1 0 0 0 0 15 19 1 0 0 0 0 15 20 2 0 0 0 0 16 17 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 19 21 2 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 21 23 1 0 0 0 0 21 33 1 0 0 0 0 22 23 2 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 M CHG 2 3 -1 7 1 M END > 3380 > 1 > 519 > 5 > 0 > 1 > AAADccB7MQAAAAAAAAAAAAAAAAAAAAAAAAAwYAAABAAAAAABQAAAHwAEAAAADAjBmAwywIMQQACpAyVyVwCCAAAhAgAoiACoZJoIYKLAkZGUIAhghgDIyAcQgMAOAACAQAACAAAAAQCAAAQAAAAAAAAAAA== > 5-(2-fluorophenyl)-1-methyl-7-nitro-3H-1,4-benzodiazepin-2-one > 5-(2-fluorophenyl)-1-methyl-7-nitro-3H-1,4-benzodiazepin-2-one > 5-(2-fluorophenyl)-1-methyl-7-nitro-3H-1,4-benzodiazepin-2-one > 5-(2-fluorophenyl)-1-methyl-7-nitro-3H-1,4-benzodiazepin-2-one > 5-(2-fluorophenyl)-1-methyl-7-nitro-3H-1,4-benzodiazepin-2-one > 5-(2-fluorophenyl)-1-methyl-7-nitro-3H-1,4-benzodiazepin-2-one > InChI=1S/C16H12FN3O3/c1-19-14-7-6-10(20(22)23)8-12(14)16(18-9-15(19)21)11-4-2-3-5-13(11)17/h2-8H,9H2,1H3 > PPTYJKAXVCCBDU-UHFFFAOYSA-N > 2.1 > 313.08626942 > C16H12FN3O3 > 313.28 > CN1C(=O)CN=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3F > CN1C(=O)CN=C(C2=C1C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3F > 78.5 > 313.08626942 > 0 > 23 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 16 8 13 17 8 15 19 8 15 20 8 16 17 8 19 21 8 20 22 8 21 23 8 22 23 8 8 11 8 8 9 8 9 13 8 $$$$