69799129 -OEChem-05132420462D 66 69 0 0 0 0 0 0 0999 V2000 6.0773 -0.6423 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3542 0.5279 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0566 -2.4212 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9855 -1.7719 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7023 3.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7023 3.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9952 2.7558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4094 2.7558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9952 1.7558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4094 1.7558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7023 1.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7023 1.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0268 0.3114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3779 0.3114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0504 0.5279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3274 -0.6423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3748 -0.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6519 -1.3796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6756 -1.1632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0298 -0.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7291 -1.1631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0061 0.0070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3810 -1.6840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4047 -1.9004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6817 -0.7302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0329 -2.2048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7085 -2.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6848 -2.7256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3603 -3.4629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3366 -3.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9618 -1.5555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6373 -2.2928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8628 4.0618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1654 3.7729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2393 3.7729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5418 4.0618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6852 3.2928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3963 2.5953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0083 2.5953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7194 3.2928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3963 1.9163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6852 1.2189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7194 1.2189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0083 1.9163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8640 1.1192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9327 -0.7765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5406 1.1192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7695 -0.0752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8384 -1.9709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5429 -1.4816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5811 -2.3575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4571 -2.3193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1238 -1.2973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1925 0.5983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2182 -2.4917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2870 -0.5961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5558 -1.8717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7956 -1.6320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8701 -3.0126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1856 -3.2752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9457 -3.5149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1739 -4.0542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7555 -3.7036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1482 -0.9642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2426 -2.1586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 14 1 0 0 0 0 2 20 1 0 0 0 0 2 48 1 0 0 0 0 3 24 1 0 0 0 0 3 27 1 0 0 0 0 3 60 1 0 0 0 0 4 29 1 0 0 0 0 4 32 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 8 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 9 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 10 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 11 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 12 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 2 3 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 15 17 1 0 0 0 0 15 46 1 0 0 0 0 16 18 2 0 0 0 0 16 47 1 0 0 0 0 17 19 2 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 19 21 1 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 25 1 0 0 0 0 22 54 1 0 0 0 0 23 26 2 0 0 0 0 23 55 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 56 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 30 63 1 0 0 0 0 31 33 2 0 0 0 0 31 64 1 0 0 0 0 32 33 1 0 0 0 0 32 65 1 0 0 0 0 33 66 1 0 0 0 0 M END > 69799129 > 1 > 629 > 3 > 2 > 7 > AAADcfB7IAAAAAAAAAAAAAAAAAAAAAAAAAA8YIAAAAAQAAAB0AAAHgAQAAAADAjBngQ+wJLIEACoAzV3VACCgCAxAiAI2KE4ZNgIIPLA0ZGEIAhglADIyQcYiMCOQACAAAAAAACAAQAAAAAAAAAAAAAAAA== > 2-(p-tolyl)-N-[4-[2-(2-pyridyl)ethylamino]phenyl]cyclooctene-1-carboxamide > 2-(4-methylphenyl)-N-[4-[2-(2-pyridinyl)ethylamino]phenyl]-1-cyclooctenecarboxamide > 2-(4-methylphenyl)-N-[4-(2-pyridin-2-ylethylamino)phenyl]cyclooctene-1-carboxamide > 2-(4-methylphenyl)-N-[4-(2-pyridin-2-ylethylamino)phenyl]cyclooctene-1-carboxamide > 2-(4-methylphenyl)-N-[4-(2-pyridin-2-ylethylamino)phenyl]cyclooctene-1-carboxamide > 2-(p-tolyl)-N-[4-[2-(2-pyridyl)ethylamino]phenyl]cyclooctene-1-carboxamide > InChI=1S/C29H33N3O/c1-22-11-13-23(14-12-22)27-9-4-2-3-5-10-28(27)29(33)32-26-17-15-25(16-18-26)31-21-19-24-8-6-7-20-30-24/h6-8,11-18,20,31H,2-5,9-10,19,21H2,1H3,(H,32,33) > WCXRMZMGTLUJDK-UHFFFAOYSA-N > 6.5 > 439.262362685 > C29H33N3O > 439.6 > CC1=CC=C(C=C1)C2=C(CCCCCC2)C(=O)NC3=CC=C(C=C3)NCCC4=CC=CC=N4 > CC1=CC=C(C=C1)C2=C(CCCCCC2)C(=O)NC3=CC=C(C=C3)NCCC4=CC=CC=N4 > 54 > 439.262362685 > 0 > 33 > 0 > 0 > 0 > 1 > 0 > 1 > -1 > 1 5 255 > 11 12 1 13 15 8 13 16 8 15 17 8 16 18 8 17 19 8 18 19 8 20 22 8 20 23 8 22 25 8 23 26 8 24 25 8 24 26 8 29 30 8 30 31 8 31 33 8 32 33 8 4 29 8 4 32 8 $$$$