50742043 -OEChem-04252413072D 63 65 0 0 0 0 0 0 0999 V2000 4.4502 0.0000 0.0000 I 0 5 0 0 0 0 0 0 0 0 0 0 3.2152 7.1185 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.3937 5.2834 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2152 8.7280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7875 6.0881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7988 7.9232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7988 6.1912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 8.4232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9967 5.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 7.4232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1307 4.6163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0252 9.3143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9078 9.6795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7653 6.2977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8904 7.0828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7988 7.9232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2988 7.0572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5259 6.1680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4152 5.0772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 8.9232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8628 4.6163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2988 7.0572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 6.9232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1307 3.6163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 8.4232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8628 3.6163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 7.4232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9967 3.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 5.4237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1045 4.1266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3888 8.8121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5275 9.6779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6617 9.8166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4978 9.8701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7173 10.2695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3178 9.4890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8953 5.6915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3715 6.4277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6354 6.9040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5071 7.0191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9541 7.6995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2736 7.1466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1088 8.4602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6088 7.5941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9084 5.6801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0728 6.4600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3946 5.6968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8014 5.1645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 9.5432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3997 4.9263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9888 6.5203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 6.3032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5938 3.3063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 8.7332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3997 3.3063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 7.1132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9967 2.4963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3966 5.8377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 4.9622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3195 5.0096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5152 4.3192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9119 3.5373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6939 3.9340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 6 2 0 0 0 0 2 10 1 0 0 0 0 2 18 1 0 0 0 0 3 7 1 0 0 0 0 3 11 1 0 0 0 0 3 19 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 6 16 1 0 0 0 0 7 17 2 3 0 0 0 8 10 1 0 0 0 0 8 20 2 0 0 0 0 9 11 1 0 0 0 0 9 21 2 0 0 0 0 10 23 2 0 0 0 0 11 24 2 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 22 2 3 0 0 0 16 43 1 0 0 0 0 17 22 1 0 0 0 0 17 44 1 0 0 0 0 18 29 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 30 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 25 1 0 0 0 0 20 49 1 0 0 0 0 21 26 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 23 27 1 0 0 0 0 23 52 1 0 0 0 0 24 28 1 0 0 0 0 24 53 1 0 0 0 0 25 27 2 0 0 0 0 25 54 1 0 0 0 0 26 28 2 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 M CHG 2 1 -1 2 1 M END > 50742043 > 1 > 650 > 2 > 0 > 4 > AAADcfB7AAAAAgAAAAAAAAAAAAAAAWIAAAAwYAAAAAAAAFgBQAAAHAAAAAAADgjBGAQywIMAAACgAyRiRACCAAAhAgAIiAA4ZJgIICLAkZGEIAhggADIyAcQgMAPgAAAAAACAAAAAAAAAAQAAAAAAAAAAA== > 1-ethyl-2-[3-(1-ethyl-3,3-dimethyl-indolin-2-ylidene)prop-1-enyl]-3,3-dimethyl-indol-1-ium;iodide > 1-ethyl-2-[3-(1-ethyl-3,3-dimethyl-2-indol-1-iumyl)prop-2-enylidene]-3,3-dimethylindole;iodide > 1-ethyl-2-[3-(1-ethyl-3,3-dimethylindol-1-ium-2-yl)prop-2-enylidene]-3,3-dimethylindole;iodide > 1-ethyl-2-[3-(1-ethyl-3,3-dimethylindol-1-ium-2-yl)prop-2-enylidene]-3,3-dimethylindole;iodide > 1-ethyl-2-[3-(1-ethyl-3,3-dimethyl-indol-1-ium-2-yl)prop-2-enylidene]-3,3-dimethyl-indole;iodide > 1-ethyl-2-[3-(1-ethyl-3,3-dimethyl-indolin-2-ylidene)prop-1-enyl]-3,3-dimethyl-indol-1-ium;iodide > InChI=1S/C27H33N2.HI/c1-7-28-22-16-11-9-14-20(22)26(3,4)24(28)18-13-19-25-27(5,6)21-15-10-12-17-23(21)29(25)8-2;/h9-19H,7-8H2,1-6H3;1H/q+1;/p-1 > LGRNGKUSEZTBMB-UHFFFAOYSA-M > 512.16885 > C27H33IN2 > 512.5 > CCN1C2=CC=CC=C2C(C1=CC=CC3=[N+](C4=CC=CC=C4C3(C)C)CC)(C)C.[I-] > CCN1C2=CC=CC=C2C(C1=CC=CC3=[N+](C4=CC=CC=C4C3(C)C)CC)(C)C.[I-] > 6.2 > 512.16885 > 0 > 30 > 0 > 0 > 0 > 2 > 0 > 2 > -1 > 1 5 255 > 10 23 8 11 24 8 16 22 1 20 25 8 21 26 8 23 27 8 24 28 8 25 27 8 26 28 8 7 17 1 8 10 8 8 20 8 9 11 8 9 21 8 $$$$