16681904 -OEChem-04192403142D 75 80 0 1 0 0 0 0 0999 V2000 2.0000 5.4271 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.2569 2.9096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7469 6.7588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3848 6.7588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5103 -2.1911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5659 5.0362 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5659 1.9586 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1482 5.7407 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9280 -1.4866 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0659 3.4974 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8749 4.0852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2569 4.0852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5659 5.0362 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8749 2.9096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5659 1.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1537 5.8452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9781 5.8452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1537 1.1495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9836 5.7407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7469 0.2360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1482 1.2541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5768 4.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 6.5497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3347 -0.5730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7360 0.4450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3292 -0.4685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 4.7226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 6.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 5.5317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6968 -4.0182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1090 -3.2091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5158 -2.2956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2901 -4.9317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6913 -3.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2956 -5.0362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2791 -4.7226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8778 -5.7407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0981 -3.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8888 -5.9498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2736 -4.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4711 -6.6543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0926 -2.8956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4766 -6.7588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6804 -3.7046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1849 3.5482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4413 4.3374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6905 4.3374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9469 3.5482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2844 5.5886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4413 2.6574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1849 3.4465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5126 6.2423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4004 5.1743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1303 0.1712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4004 1.8205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9413 4.3256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 7.1161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3526 0.5098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6937 -0.9701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3301 4.1562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0368 6.9468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3114 -1.5514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9490 -3.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5950 -2.8624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6783 -3.6551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9311 -4.5346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0269 -5.2890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4945 -5.6759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7336 -2.4985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2722 -6.0146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6381 -5.1197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8355 -7.1559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3448 -2.3292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2244 -7.3252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2970 -3.6398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 2 7 1 0 0 0 0 2 10 1 0 0 0 0 3 16 2 0 0 0 0 4 17 2 0 0 0 0 5 32 2 0 0 0 0 6 12 1 0 0 0 0 6 13 1 0 0 0 0 6 17 1 0 0 0 0 7 15 2 0 0 0 0 8 16 1 0 0 0 0 8 52 1 0 0 0 0 8 53 1 0 0 0 0 9 24 1 0 0 0 0 9 32 1 0 0 0 0 9 62 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 11 13 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 16 1 6 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 18 1 0 0 0 0 17 19 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 22 2 0 0 0 0 19 23 1 0 0 0 0 20 24 1 0 0 0 0 20 54 1 0 0 0 0 21 25 2 0 0 0 0 21 55 1 0 0 0 0 22 27 1 0 0 0 0 22 56 1 0 0 0 0 23 28 2 0 0 0 0 23 57 1 0 0 0 0 24 26 2 0 0 0 0 25 26 1 0 0 0 0 25 58 1 0 0 0 0 26 59 1 0 0 0 0 27 29 2 0 0 0 0 27 60 1 0 0 0 0 28 29 1 0 0 0 0 28 61 1 0 0 0 0 30 31 1 0 0 0 0 30 33 1 0 0 0 0 30 34 1 0 0 0 0 30 63 1 0 0 0 0 31 32 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 33 35 2 0 0 0 0 33 37 1 0 0 0 0 34 36 2 0 0 0 0 34 38 1 0 0 0 0 35 39 1 0 0 0 0 35 66 1 0 0 0 0 36 40 1 0 0 0 0 36 67 1 0 0 0 0 37 41 2 0 0 0 0 37 68 1 0 0 0 0 38 42 2 0 0 0 0 38 69 1 0 0 0 0 39 43 2 0 0 0 0 39 70 1 0 0 0 0 40 44 2 0 0 0 0 40 71 1 0 0 0 0 41 43 1 0 0 0 0 41 72 1 0 0 0 0 42 44 1 0 0 0 0 42 73 1 0 0 0 0 43 74 1 0 0 0 0 44 75 1 0 0 0 0 M END > 16681904 > 1 > 1050 > 5 > 2 > 8 > AAADceB/uAAEAAAAAAAAAAAAAAAAAWIAAAAwYMGAAAAAAAABVAAAHgIUAAAADW7BmCQwwIPQAACoAyVyUACCAAAlBwAIiAG4ZtgKYLLBl7GUIQhmlgDYyYe6yeCOhAAAQAAAAAAIAACAAAAAAAAAAAAAAA== > (8S)-7-(4-chlorobenzoyl)-3-[3-(3,3-diphenylpropanoylamino)phenyl]-1-oxa-2,7-diazaspiro[4.4]non-2-ene-8-carboxamide > (8S)-7-[(4-chlorophenyl)-oxomethyl]-3-[3-[(1-oxo-3,3-diphenylpropyl)amino]phenyl]-1-oxa-2,7-diazaspiro[4.4]non-2-ene-8-carboxamide > (8S)-7-(4-chlorobenzoyl)-3-[3-(3,3-diphenylpropanoylamino)phenyl]-1-oxa-2,7-diazaspiro[4.4]non-2-ene-8-carboxamide > (8S)-7-(4-chlorobenzoyl)-3-[3-(3,3-diphenylpropanoylamino)phenyl]-1-oxa-2,7-diazaspiro[4.4]non-2-ene-8-carboxamide > (8S)-7-(4-chlorophenyl)carbonyl-3-[3-(3,3-diphenylpropanoylamino)phenyl]-1-oxa-2,7-diazaspiro[4.4]non-2-ene-8-carboxamide > (8S)-7-(4-chlorobenzoyl)-3-[3-(3,3-diphenylpropanoylamino)phenyl]-1-oxa-2,7-diazaspiro[4.4]non-2-ene-8-carboxamide > InChI=1S/C35H31ClN4O4/c36-27-16-14-25(15-17-27)34(43)40-22-35(21-31(40)33(37)42)20-30(39-44-35)26-12-7-13-28(18-26)38-32(41)19-29(23-8-3-1-4-9-23)24-10-5-2-6-11-24/h1-18,29,31H,19-22H2,(H2,37,42)(H,38,41)/t31-,35?/m0/s1 > CQLBORDEKDMTEW-MWGAKABSSA-N > 5.1 > 606.2033832 > C35H31ClN4O4 > 607.1 > C1C(N(CC12CC(=NO2)C3=CC(=CC=C3)NC(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)C6=CC=C(C=C6)Cl)C(=O)N > C1[C@H](N(CC12CC(=NO2)C3=CC(=CC=C3)NC(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5)C(=O)C6=CC=C(C=C6)Cl)C(=O)N > 114 > 606.2033832 > 0 > 44 > 1 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 11 3 13 16 6 18 20 8 18 21 8 19 22 8 19 23 8 20 24 8 21 25 8 22 27 8 23 28 8 24 26 8 25 26 8 27 29 8 28 29 8 33 35 8 33 37 8 34 36 8 34 38 8 35 39 8 36 40 8 37 41 8 38 42 8 39 43 8 40 44 8 41 43 8 42 44 8 $$$$