4431 -OEChem-05062419552D 56 59 0 0 0 0 0 0 0999 V2000 12.2619 -2.1767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 3.0427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -0.4678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 -0.4446 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 -0.4446 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 1.2874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -1.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 0.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 -1.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 0.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 -0.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 0.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 0.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2619 -0.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 1.2874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7619 -1.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7619 0.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 2.0922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7619 -1.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7619 0.4214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2619 -0.4446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.2874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7619 -3.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1793 -1.5227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8695 -1.9212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8695 1.0320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1793 0.6335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6542 -1.9212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3445 -1.5227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3445 0.6335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6542 1.0320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6793 -0.6567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3695 -1.0552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3445 0.6335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6542 1.0320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1793 0.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8695 -0.1892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8445 1.4995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 1.8980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4519 0.9583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0719 -1.8476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0719 0.9583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8819 -0.4446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.9074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.0974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.4774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2249 -3.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0719 -3.5796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2988 -2.7327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 29 1 0 0 0 0 2 18 2 0 0 0 0 3 19 2 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 14 1 0 0 0 0 6 15 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 9 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 10 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 15 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 16 1 0 0 0 0 14 17 2 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 22 2 0 0 0 0 17 23 1 0 0 0 0 17 46 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 26 2 0 0 0 0 22 24 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 27 1 0 0 0 0 25 50 1 0 0 0 0 26 28 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 M END > 4431 > 1 > 552 > 5 > 0 > 7 > AAADceB7MAAAAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAFgBQAAAHgAAAAAADAzBmAYyxoMABACIAiVSUACCCAAlIgAIiAEPbMgOZjLEtZuVMShkxjHY6YedyICOgAAAAAAQEAAAAAAAACAgAAAAAAAAAA== > 2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]isoindoline-1,3-dione > 2-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butyl]isoindole-1,3-dione > 2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]isoindole-1,3-dione > 2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]isoindole-1,3-dione > 2-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]isoindole-1,3-dione > 2-[4-[4-(2-methoxyphenyl)piperazino]butyl]isoindoline-1,3-quinone > InChI=1S/C23H27N3O3/c1-29-21-11-5-4-10-20(21)25-16-14-24(15-17-25)12-6-7-13-26-22(27)18-8-2-3-9-19(18)23(26)28/h2-5,8-11H,6-7,12-17H2,1H3 > SJDOMIRMMUGQQK-UHFFFAOYSA-N > 3.2 > 393.20524173 > C23H27N3O3 > 393.5 > COC1=CC=CC=C1N2CCN(CC2)CCCCN3C(=O)C4=CC=CC=C4C3=O > COC1=CC=CC=C1N2CCN(CC2)CCCCN3C(=O)C4=CC=CC=C4C3=O > 53.1 > 393.20524173 > 0 > 29 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 14 16 8 14 17 8 16 22 8 17 23 8 20 21 8 20 25 8 21 26 8 22 24 8 23 24 8 25 27 8 26 28 8 27 28 8 $$$$