56591770 -OEChem-05122420102D 74 73 0 1 0 0 0 0 0999 V2000 9.7705 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.4050 10.1200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 5.0065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2711 8.6200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 7.0065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 5.0065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 4.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5390 4.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5390 5.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 3.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8070 4.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5390 7.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5390 8.6200 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4050 6.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 6.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4050 7.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 7.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 6.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 8.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 6.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 9.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 5.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 4.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4050 9.1200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8671 8.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7331 7.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 3.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 3.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 2.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 2.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 4.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 4.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 2.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 4.7400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7511 4.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1496 4.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0530 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 2.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2930 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1170 5.1569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2700 4.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4970 4.0831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5390 9.2400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9420 5.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 5.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9420 7.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 7.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9230 7.0891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5244 6.3989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 8.5891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3905 7.8989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4685 6.0316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2656 6.0316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9830 9.6569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1360 9.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3630 8.5831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 5.3165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1771 7.9696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 8.8165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5571 9.0435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0431 6.4696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2700 7.3165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4231 7.5435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 2.1965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 2.1965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 4.5435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 4.3165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 3.4696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 3.4696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 4.3165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 4.5435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 1.3865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9420 10.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7705 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 74 1 0 0 0 0 2 24 1 0 0 0 0 2 73 1 0 0 0 0 3 22 2 0 0 0 0 4 24 2 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 6 57 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 14 2 0 0 0 0 9 15 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 21 1 0 0 0 0 13 24 1 0 0 0 0 13 43 1 0 0 0 0 14 16 1 0 0 0 0 14 44 1 0 0 0 0 15 17 2 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 18 22 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 25 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 26 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 23 27 2 0 0 0 0 23 28 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 27 29 1 0 0 0 0 27 31 1 0 0 0 0 28 30 2 0 0 0 0 28 32 1 0 0 0 0 29 33 2 0 0 0 0 29 64 1 0 0 0 0 30 33 1 0 0 0 0 30 65 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 32 71 1 0 0 0 0 33 72 1 0 0 0 0 M END > 56591770 > 1 > 431 > 4 > 3 > 9 > AAADcfB7MAAEAAAAAAAAAAAAAAAAAAAAAAAwYAAAAAAAAAABQAAAHgAQCAAADQjBmAQyyIPAAgCIAiXSWACCAAAhAAAIiAGIRIgIYDLAlbGUYAhk1AHIyAeYyOCOwAACAAACAACAAAQAAAQAAAAAAAAAAA== > 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide;2-(4-isobutylphenyl)propanoic acid;hydrochloride > 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide;2-[4-(2-methylpropyl)phenyl]propanoic acid;hydrochloride > 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide;2-[4-(2-methylpropyl)phenyl]propanoic acid;hydrochloride > 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide;2-[4-(2-methylpropyl)phenyl]propanoic acid;hydrochloride > 2-(diethylamino)-N-(2,6-dimethylphenyl)ethanamide;2-[4-(2-methylpropyl)phenyl]propanoic acid;hydrochloride > 2-(diethylamino)-N-(2,6-dimethylphenyl)acetamide;2-(4-isobutylphenyl)propionic acid;hydrochloride > InChI=1S/C14H22N2O.C13H18O2.ClH/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4;1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15;/h7-9H,5-6,10H2,1-4H3,(H,15,17);4-7,9-10H,8H2,1-3H3,(H,14,15);1H > WHHRYERYRYYEQD-UHFFFAOYSA-N > 476.2805709 > C27H41ClN2O3 > 477.1 > CCN(CC)CC(=O)NC1=C(C=CC=C1C)C.CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.Cl > CCN(CC)CC(=O)NC1=C(C=CC=C1C)C.CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.Cl > 69.6 > 476.2805709 > 0 > 33 > 0 > 1 > 0 > 0 > 0 > 3 > -1 > 1 5 255 > 12 16 8 12 17 8 13 21 3 14 16 8 15 17 8 23 27 8 23 28 8 27 29 8 28 30 8 29 33 8 30 33 8 9 14 8 9 15 8 $$$$