53301230 -OEChem-03282415172D 56 60 0 1 0 0 0 0 0999 V2000 8.9025 -3.2272 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.2731 -1.7050 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.9351 -2.5413 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9133 -2.7492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3026 1.3823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6554 0.8471 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2952 -0.8471 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9862 0.1040 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4895 -1.4293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9922 0.1014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6858 -0.8443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2734 -1.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6043 -1.7982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9425 -0.3119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6335 0.6392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3463 1.7982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3106 0.8809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6766 -1.0761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5800 -2.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9772 -0.3125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9646 -0.5127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2963 0.6725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0155 2.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5971 -2.2749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2941 -1.5008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2442 -3.4924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7065 3.4924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9936 2.3334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5750 -4.2355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3756 4.2355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6628 3.0765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3537 4.0276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6395 0.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0740 -1.8895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9034 -1.8909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9646 2.2867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7989 1.5071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5084 1.4684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4923 -1.6680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1598 -2.5064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3741 -0.0472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8828 1.1345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8682 0.0808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3942 -0.6568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1318 -1.1309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6259 -3.9809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7916 -3.2013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 3.6213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1852 1.7437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1143 -3.8206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1602 -4.6962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0358 -4.6504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1840 4.8252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2692 2.9476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7686 4.4883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 25 1 0 0 0 0 3 13 1 0 0 0 0 3 27 1 0 0 0 0 4 13 2 0 0 0 0 5 15 2 0 0 0 0 6 8 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 7 13 1 6 0 0 0 8 10 1 0 0 0 0 8 34 1 6 0 0 0 9 11 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 18 1 0 0 0 0 12 14 1 0 0 0 0 12 19 2 0 0 0 0 14 15 1 0 0 0 0 14 21 2 0 0 0 0 16 23 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 22 2 0 0 0 0 17 39 1 0 0 0 0 18 20 2 0 0 0 0 18 40 1 0 0 0 0 19 24 1 0 0 0 0 19 41 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 21 25 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 28 2 0 0 0 0 23 29 1 0 0 0 0 24 25 2 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 30 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 31 1 0 0 0 0 28 49 1 0 0 0 0 29 32 2 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 33 2 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 33 56 1 0 0 0 0 M END > 53301230 > 1 > 756 > 5 > 0 > 5 > AAADceB6MYAAAAAAAAAAAAAAAAAAAYAAAAA8YMEAAAAAAHixUAAAHwAAAAAADijhmA4yCIMABACIAiHSGACCAAAkAAAIiAEIBMgIIDqAlRGGIQhmxgGIiYeY3/KfwAACAAAQAACAAAQAACAAASAACQAAAA== > ethyl (6aR,11aS)-6-benzyl-2,3-difluoro-9-methyl-5-oxo-6a,11-dihydroindeno[1,2-c]isoquinoline-11a-carboxylate > (6aR,11aS)-2,3-difluoro-9-methyl-5-oxo-6-(phenylmethyl)-6a,11-dihydroindeno[1,2-c]isoquinoline-11a-carboxylic acid ethyl ester > ethyl (6aR,11aS)-6-benzyl-2,3-difluoro-9-methyl-5-oxo-6a,11-dihydroindeno[1,2-c]isoquinoline-11a-carboxylate > ethyl (6aR,11aS)-6-benzyl-2,3-difluoro-9-methyl-5-oxo-6a,11-dihydroindeno[1,2-c]isoquinoline-11a-carboxylate > ethyl (6aR,11aS)-2,3-bis(fluoranyl)-9-methyl-5-oxidanylidene-6-(phenylmethyl)-6a,11-dihydroindeno[1,2-c]isoquinoline-11a-carboxylate > (6aR,11aS)-6-benzyl-2,3-difluoro-5-keto-9-methyl-6a,11-dihydroinden[1,2-c]isoquinoline-11a-carboxylic acid ethyl ester > InChI=1S/C27H23F2NO3/c1-3-33-26(32)27-14-18-11-16(2)9-10-19(18)24(27)30(15-17-7-5-4-6-8-17)25(31)20-12-22(28)23(29)13-21(20)27/h4-13,24H,3,14-15H2,1-2H3/t24-,27+/m1/s1 > CBYZWQWUKDOWJY-SQHAQQRYSA-N > 4.8 > 447.16459992 > C27H23F2NO3 > 447.5 > CCOC(=O)C12CC3=C(C1N(C(=O)C4=CC(=C(C=C24)F)F)CC5=CC=CC=C5)C=CC(=C3)C > CCOC(=O)[C@]12CC3=C([C@H]1N(C(=O)C4=CC(=C(C=C24)F)F)CC5=CC=CC=C5)C=CC(=C3)C > 46.6 > 447.16459992 > 0 > 33 > 2 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 11 8 10 17 8 11 18 8 12 14 8 12 19 8 14 21 8 17 22 8 18 20 8 19 24 8 20 22 8 21 25 8 23 28 8 23 29 8 24 25 8 28 31 8 29 32 8 31 33 8 32 33 8 7 13 6 8 34 6 $$$$