69125782 -OEChem-04232420562D 74 77 0 1 0 0 0 0 0999 V2000 10.6603 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -4.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 2.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 5.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.7500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1962 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 -2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9841 -1.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 -1.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7383 1.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1369 1.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 3.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 3.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -2.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4482 1.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0497 1.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3957 2.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1928 2.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2382 3.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6182 2.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -4.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -6.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -6.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -6.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 4.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -3.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9893 4.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -6.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 6.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 6.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -6.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 19 1 0 0 0 0 2 20 1 0 0 0 0 2 66 1 0 0 0 0 3 20 2 0 0 0 0 4 21 2 0 0 0 0 5 29 2 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 21 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 7 49 1 0 0 0 0 8 34 1 0 0 0 0 8 38 2 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 17 2 0 0 0 0 11 18 1 0 0 0 0 12 14 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 15 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 25 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 22 1 0 0 0 0 16 26 2 0 0 0 0 17 23 1 0 0 0 0 17 54 1 0 0 0 0 18 24 2 0 0 0 0 18 55 1 0 0 0 0 19 23 2 0 0 0 0 19 24 1 0 0 0 0 21 27 1 0 0 0 0 22 28 2 0 0 0 0 22 29 1 0 0 0 0 23 56 1 0 0 0 0 24 57 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 30 1 0 0 0 0 26 61 1 0 0 0 0 27 33 1 0 0 0 0 27 34 2 0 0 0 0 28 31 1 0 0 0 0 28 62 1 0 0 0 0 29 32 1 0 0 0 0 30 31 2 0 0 0 0 30 63 1 0 0 0 0 31 64 1 0 0 0 0 32 35 2 0 0 0 0 32 36 1 0 0 0 0 33 37 2 0 0 0 0 33 65 1 0 0 0 0 34 67 1 0 0 0 0 35 39 1 0 0 0 0 35 68 1 0 0 0 0 36 40 2 0 0 0 0 36 69 1 0 0 0 0 37 38 1 0 0 0 0 37 70 1 0 0 0 0 38 71 1 0 0 0 0 39 41 2 0 0 0 0 39 72 1 0 0 0 0 40 41 1 0 0 0 0 40 73 1 0 0 0 0 41 74 1 0 0 0 0 M END > 69125782 > 1 > 824 > 7 > 2 > 14 > AAADcfB/OAAAAAAAAAAAAAAAAAAAAAAAAAA8YMEAAAAAAAAB1AAAHgAQCAAADCzhmgY+zpPIFgCoArX3XACCiCA1IiAI2KG+bNgOJvrE9buHeajk1hHY6ceYyeCOIAAAAAACAABAAAAAAAQAAAAAAAAAAA== > 2-(2-benzoylanilino)-3-[4-[2-[propyl(pyridine-3-carbonyl)amino]ethoxy]phenyl]propanoic acid > 2-(2-benzoylanilino)-3-[4-[2-[[oxo(3-pyridinyl)methyl]-propylamino]ethoxy]phenyl]propanoic acid > 2-(2-benzoylanilino)-3-[4-[2-[propyl(pyridine-3-carbonyl)amino]ethoxy]phenyl]propanoic acid > 2-(2-benzoylanilino)-3-[4-[2-[propyl(pyridine-3-carbonyl)amino]ethoxy]phenyl]propanoic acid > 2-[[2-(phenylcarbonyl)phenyl]amino]-3-[4-[2-[propyl(pyridin-3-ylcarbonyl)amino]ethoxy]phenyl]propanoic acid > 2-(2-benzoylanilino)-3-[4-[2-[nicotinoyl(propyl)amino]ethoxy]phenyl]propionic acid > InChI=1S/C33H33N3O5/c1-2-19-36(32(38)26-11-8-18-34-23-26)20-21-41-27-16-14-24(15-17-27)22-30(33(39)40)35-29-13-7-6-12-28(29)31(37)25-9-4-3-5-10-25/h3-18,23,30,35H,2,19-22H2,1H3,(H,39,40) > AGAJYJOFRXHXOJ-UHFFFAOYSA-N > 6.3 > 551.24202116 > C33H33N3O5 > 551.6 > CCCN(CCOC1=CC=C(C=C1)CC(C(=O)O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3)C(=O)C4=CN=CC=C4 > CCCN(CCOC1=CC=C(C=C1)CC(C(=O)O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3)C(=O)C4=CN=CC=C4 > 109 > 551.24202116 > 0 > 41 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 17 8 11 18 8 16 22 8 16 26 8 17 23 8 18 24 8 19 23 8 19 24 8 22 28 8 26 30 8 27 33 8 27 34 8 28 31 8 30 31 8 32 35 8 32 36 8 33 37 8 35 39 8 36 40 8 37 38 8 39 41 8 40 41 8 8 34 8 8 38 8 9 10 3 $$$$