66572097 -OEChem-04192412342D 95 95 0 0 0 0 0 0 0999 V2000 6.0830 4.9944 0.0000 Br 0 5 0 0 0 0 0 0 0 0 0 0 6.0830 2.4972 0.0000 Br 0 5 0 0 0 0 0 0 0 0 0 0 6.0830 0.0000 0.0000 Br 0 5 0 0 0 0 0 0 0 0 0 0 3.2152 12.1137 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.7875 11.0834 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5008 8.7241 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 11.0802 12.1595 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2152 13.7232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3937 10.2786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7988 12.9185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7988 11.1864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 13.4185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1307 9.6115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 12.4185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9967 10.1115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5259 11.1632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4554 11.8277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 10.4189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4339 11.6214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9078 14.6748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0252 14.3096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7233 9.5366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4809 10.6869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1687 9.4684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1017 12.3657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7988 12.9185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2988 12.0524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 13.9185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1307 8.6115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2988 12.0524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 11.9185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8628 9.6115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 7.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2452 8.0562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7565 9.3919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0587 11.9533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2865 13.1380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8740 11.1810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 13.4185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9967 8.1115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 12.4185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8628 8.6115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9084 10.6753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0728 11.4552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6866 12.4029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9290 12.1553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4755 10.9068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3111 10.1269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2026 11.0462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9602 11.2938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4978 14.8654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7173 15.2648 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3178 14.4842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3888 13.8074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5275 14.6731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6617 14.8118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2632 9.9523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3076 9.0766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1833 9.1210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7340 11.2529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9149 10.9401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2277 10.1210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5512 8.9805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7156 9.7604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3330 12.9410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5754 12.6934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1088 13.4554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6088 12.5894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 14.5385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5938 8.3015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9888 11.5155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 11.2985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3997 9.9215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3715 8.3938 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4189 7.5183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2945 7.5657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8311 7.5948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7066 7.6422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6592 8.5177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1706 9.8534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2951 9.8060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3425 8.9305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9309 11.3466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6654 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1866 12.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8931 13.0102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4143 13.7447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6798 13.2659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2673 11.3089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7462 10.5743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4807 11.0532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 13.7285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9967 7.4915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 12.1085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3997 8.3015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4 10 2 0 0 0 0 4 14 1 0 0 0 0 4 16 1 0 0 0 0 5 11 1 0 0 0 0 5 15 1 0 0 0 0 5 17 1 0 0 0 0 6 24 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 25 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 26 1 0 0 0 0 11 27 2 0 0 0 0 12 14 1 0 0 0 0 12 28 2 0 0 0 0 13 15 1 0 0 0 0 13 29 2 0 0 0 0 14 31 2 0 0 0 0 15 32 2 0 0 0 0 16 18 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 19 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 24 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 25 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 24 63 1 0 0 0 0 24 64 1 0 0 0 0 25 65 1 0 0 0 0 25 66 1 0 0 0 0 26 30 2 0 0 0 0 26 67 1 0 0 0 0 27 30 1 0 0 0 0 27 68 1 0 0 0 0 28 39 1 0 0 0 0 28 69 1 0 0 0 0 29 40 1 0 0 0 0 29 70 1 0 0 0 0 30 71 1 0 0 0 0 31 41 1 0 0 0 0 31 72 1 0 0 0 0 32 42 1 0 0 0 0 32 73 1 0 0 0 0 33 74 1 0 0 0 0 33 75 1 0 0 0 0 33 76 1 0 0 0 0 34 77 1 0 0 0 0 34 78 1 0 0 0 0 34 79 1 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 36 83 1 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 37 86 1 0 0 0 0 37 87 1 0 0 0 0 37 88 1 0 0 0 0 38 89 1 0 0 0 0 38 90 1 0 0 0 0 38 91 1 0 0 0 0 39 41 2 0 0 0 0 39 92 1 0 0 0 0 40 42 2 0 0 0 0 40 93 1 0 0 0 0 41 94 1 0 0 0 0 42 95 1 0 0 0 0 M CHG 6 1 -1 2 -1 3 -1 4 1 6 1 7 1 M END > 66572097 > 1 > 865 > 4 > 0 > 10 > AAADcfB/gAAAGAAAAAAAAAAAAAAAAWIAAAAwYAAAAAAAAFgBQAAAHAAAAAAADgjBGAQywIMAAACgAyRiRACCAAAhAgAIiAA4ZJgIICLA0ZGEIAhggADIyAcQgMAPgAAAAAACAAAAAAAAAAQAAAAAAAAAAA== > 3-[2-[(E,3E)-3-[3,3-dimethyl-1-[3-(trimethylammonio)propyl]indolin-2-ylidene]prop-1-enyl]-3,3-dimethyl-indol-1-ium-1-yl]propyl-trimethyl-ammonium;tribromide > 3-[(2E)-2-[(E)-3-[3,3-dimethyl-1-[3-(trimethylammonio)propyl]-2-indol-1-iumyl]prop-2-enylidene]-3,3-dimethyl-1-indolyl]propyl-trimethylammonium;tribromide > 3-[(2E)-2-[(E)-3-[3,3-dimethyl-1-[3-(trimethylazaniumyl)propyl]indol-1-ium-2-yl]prop-2-enylidene]-3,3-dimethylindol-1-yl]propyl-trimethylazanium;tribromide > 3-[(2E)-2-[(E)-3-[3,3-dimethyl-1-[3-(trimethylazaniumyl)propyl]indol-1-ium-2-yl]prop-2-enylidene]-3,3-dimethylindol-1-yl]propyl-trimethylazanium;tribromide > 3-[(2E)-2-[(E)-3-[3,3-dimethyl-1-[3-(trimethylazaniumyl)propyl]indol-1-ium-2-yl]prop-2-enylidene]-3,3-dimethyl-indol-1-yl]propyl-trimethyl-azanium;tribromide > 3-[2-[(E,3E)-3-[3,3-dimethyl-1-[3-(trimethylammonio)propyl]indolin-2-ylidene]prop-1-enyl]-3,3-dimethyl-indol-1-ium-1-yl]propyl-trimethyl-ammonium;tribromide > InChI=1S/C35H53N4.3BrH/c1-34(2)28-18-11-13-20-30(28)36(24-16-26-38(5,6)7)32(34)22-15-23-33-35(3,4)29-19-12-14-21-31(29)37(33)25-17-27-39(8,9)10;;;/h11-15,18-23H,16-17,24-27H2,1-10H3;3*1H/q+3;;;/p-3 > KHZABSRPYAULPU-UHFFFAOYSA-K > 768.17999 > C35H53Br3N4 > 769.5 > CC1(C2=CC=CC=C2[N+](=C1C=CC=C3C(C4=CC=CC=C4N3CCC[N+](C)(C)C)(C)C)CCC[N+](C)(C)C)C.[Br-].[Br-].[Br-] > CC1(C2=CC=CC=C2[N+](=C1/C=C/C=C/3\C(C4=CC=CC=C4N3CCC[N+](C)(C)C)(C)C)CCC[N+](C)(C)C)C.[Br-].[Br-].[Br-] > 6.2 > 766.18204 > 0 > 42 > 0 > 0 > 2 > 0 > 0 > 4 > -1 > 1 5 255 > 12 14 8 12 28 8 13 15 8 13 29 8 14 31 8 15 32 8 28 39 8 29 40 8 31 41 8 32 42 8 39 41 8 40 42 8 $$$$