71198177 -OEChem-04252402022D 64 67 0 1 0 0 0 0 0999 V2000 4.5981 4.8623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.8623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6377 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3623 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 -6.1723 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1377 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7320 1.3623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.8623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.6377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.6377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.6377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.8623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.6377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 -4.1030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.6377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -6.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -4.6168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.3623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.3623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 -5.6585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -4.1135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.3623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.3623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.8623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 -4.6102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -1.7203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -1.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -1.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -1.7203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -0.2453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 0.4449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.4449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -0.2453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -2.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -3.2203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 1.2547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 1.9449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 1.9700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 1.2797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 -3.1746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.3277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 -2.1007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -4.3277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3509 -3.4830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -5.9477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -6.7577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.0523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.0523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7998 -5.9706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5249 -3.6370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7278 -3.6401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 4.6723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6882 -5.1483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5343 -4.9181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3041 -4.0720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 4.5523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 6.1723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 63 1 0 0 0 0 2 30 1 0 0 0 0 2 64 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 10 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 5 19 1 0 0 0 0 5 26 2 0 0 0 0 6 8 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 9 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 11 42 1 0 0 0 0 12 14 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 19 1 0 0 0 0 16 20 1 0 0 0 0 17 21 2 0 0 0 0 17 50 1 0 0 0 0 18 24 2 0 0 0 0 18 25 1 0 0 0 0 19 22 2 0 0 0 0 20 23 2 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 53 1 0 0 0 0 23 26 1 0 0 0 0 23 27 1 0 0 0 0 24 28 1 0 0 0 0 24 54 1 0 0 0 0 25 29 2 0 0 0 0 25 55 1 0 0 0 0 26 56 1 0 0 0 0 27 31 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 28 30 2 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 M END > 71198177 > 1 > 539 > 5 > 2 > 7 > AAADcfB7MAAAAAAAAAAAAAAAAAAAAAAAAAA8eIEAAAAAAACx9AAAHgAACAAADQzBngQ+xvMIEgCgAzRnRACCgCAxIiAI2CA+7JgJZuLCkZOUcAlkwBHJ2AeQ0PIOoAABQAASQABAAAKAACSAAAAAAAAAAA== > 4-[2-[4-[2-(3-ethyl-5-quinolyl)propyl]piperazin-1-yl]ethyl]benzene-1,2-diol > 4-[2-[4-[2-(3-ethyl-5-quinolinyl)propyl]-1-piperazinyl]ethyl]benzene-1,2-diol > 4-[2-[4-[2-(3-ethylquinolin-5-yl)propyl]piperazin-1-yl]ethyl]benzene-1,2-diol > 4-[2-[4-[2-(3-ethylquinolin-5-yl)propyl]piperazin-1-yl]ethyl]benzene-1,2-diol > 4-[2-[4-[2-(3-ethylquinolin-5-yl)propyl]piperazin-1-yl]ethyl]benzene-1,2-diol > 4-[2-[4-[2-(3-ethyl-5-quinolyl)propyl]piperazino]ethyl]pyrocatechol > InChI=1S/C26H33N3O2/c1-3-20-15-23-22(5-4-6-24(23)27-17-20)19(2)18-29-13-11-28(12-14-29)10-9-21-7-8-25(30)26(31)16-21/h4-8,15-17,19,30-31H,3,9-14,18H2,1-2H3 > JPHYDQRLFPDDBI-UHFFFAOYSA-N > 4.7 > 419.25727730 > C26H33N3O2 > 419.6 > CCC1=CC2=C(C=CC=C2N=C1)C(C)CN3CCN(CC3)CCC4=CC(=C(C=C4)O)O > CCC1=CC2=C(C=CC=C2N=C1)C(C)CN3CCN(CC3)CCC4=CC(=C(C=C4)O)O > 59.8 > 419.25727730 > 0 > 31 > 0 > 1 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 11 15 3 13 16 8 13 17 8 16 19 8 16 20 8 17 21 8 18 24 8 18 25 8 19 22 8 20 23 8 21 22 8 23 26 8 24 28 8 25 29 8 28 30 8 29 30 8 5 19 8 5 26 8 $$$$