10673258 -OEChem-04252405502D 69 72 0 1 0 0 0 0 0999 V2000 10.6603 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 3.5000 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 12.3923 5.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1962 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 5.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 -1.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9841 -0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 -1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -2.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -3.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7383 1.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1369 2.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4482 2.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0497 1.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -5.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -5.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9703 4.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1233 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3503 3.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 -3.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 -1.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 3.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 6.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 5.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 21 1 0 0 0 0 2 12 1 0 0 0 0 2 29 1 0 0 0 0 3 12 2 0 0 0 0 4 23 2 0 0 0 0 8 5 1 6 0 0 0 5 11 1 0 0 0 0 5 42 1 0 0 0 0 6 20 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 27 1 0 0 0 0 7 37 2 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 15 1 0 0 0 0 11 19 2 0 0 0 0 13 17 1 0 0 0 0 13 43 1 0 0 0 0 14 18 2 0 0 0 0 14 44 1 0 0 0 0 15 22 2 0 0 0 0 15 23 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 19 24 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 25 1 0 0 0 0 22 52 1 0 0 0 0 23 26 1 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 26 30 2 0 0 0 0 26 31 1 0 0 0 0 27 32 2 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 30 33 1 0 0 0 0 30 61 1 0 0 0 0 31 34 2 0 0 0 0 31 62 1 0 0 0 0 32 36 1 0 0 0 0 32 63 1 0 0 0 0 33 35 2 0 0 0 0 33 64 1 0 0 0 0 34 35 1 0 0 0 0 34 65 1 0 0 0 0 35 67 1 0 0 0 0 36 38 2 0 0 0 0 36 66 1 0 0 0 0 37 38 1 0 0 0 0 37 68 1 0 0 0 0 38 69 1 0 0 0 0 M END > 10673258 > 1 > 720 > 7 > 1 > 13 > AAADceB7OAAAAAAAAAAAAAAAAAAAAAAAAAA8YMEAAAAAAAAB1AAAHgAQAAAADCzhmgY//pPIFACoArb3bACCiCk1IiAJ2KG+bNiOJvrEvbuHOajs0BPY6eeYyOCOIAAAAAACAABAAAAAAAQAAAAAAAAAAA== > methyl (2R)-2-(2-benzoylanilino)-3-[4-[2-[methyl(2-pyridyl)amino]ethoxy]phenyl]propanoate > (2R)-2-(2-benzoylanilino)-3-[4-[2-[methyl(2-pyridinyl)amino]ethoxy]phenyl]propanoic acid methyl ester > methyl (2R)-2-(2-benzoylanilino)-3-[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]propanoate > methyl (2R)-2-(2-benzoylanilino)-3-[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]propanoate > methyl (2R)-3-[4-[2-[methyl(pyridin-2-yl)amino]ethoxy]phenyl]-2-[[2-(phenylcarbonyl)phenyl]amino]propanoate > (2R)-2-(2-benzoylanilino)-3-[4-[2-[methyl(2-pyridyl)amino]ethoxy]phenyl]propionic acid methyl ester > InChI=1S/C31H31N3O4/c1-34(29-14-8-9-19-32-29)20-21-38-25-17-15-23(16-18-25)22-28(31(36)37-2)33-27-13-7-6-12-26(27)30(35)24-10-4-3-5-11-24/h3-19,28,33H,20-22H2,1-2H3/t28-/m1/s1 > FZCQJMSDTTVWLY-MUUNZHRXSA-N > 6.8 > 509.23145648 > C31H31N3O4 > 509.6 > CN(CCOC1=CC=C(C=C1)CC(C(=O)OC)NC2=CC=CC=C2C(=O)C3=CC=CC=C3)C4=CC=CC=N4 > CN(CCOC1=CC=C(C=C1)C[C@H](C(=O)OC)NC2=CC=CC=C2C(=O)C3=CC=CC=C3)C4=CC=CC=N4 > 80.8 > 509.23145648 > 0 > 38 > 1 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 13 8 10 14 8 11 15 8 11 19 8 13 17 8 14 18 8 15 22 8 16 17 8 16 18 8 19 24 8 22 25 8 24 25 8 26 30 8 26 31 8 27 32 8 30 33 8 31 34 8 32 36 8 33 35 8 34 35 8 36 38 8 37 38 8 8 5 6 7 27 8 7 37 8 $$$$