1501905 OpenBabel05072014453D 61 64 0 0 1 0 0 0 0 0999 V2000 3.8538 1.2159 8.6012 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3187 1.9161 7.5159 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7372 1.2291 6.3921 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5114 3.1781 9.8911 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7732 0.6420 2.8394 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4883 0.1273 2.0705 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 1.4990 3.2413 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5338 0.9383 0.8632 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4598 1.7745 9.7829 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6965 0.6036 0.5821 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3634 1.3277 1.9490 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5878 0.0230 5.0087 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4756 0.5333 4.0553 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2527 1.0173 1.5701 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4578 0.1503 3.0812 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2082 2.7896 1.5183 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7855 3.5764 2.5051 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4648 4.7089 2.1487 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5850 5.0941 0.8281 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3285 3.1517 0.2007 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3221 6.3463 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3525 2.8456 7.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0569 1.7152 5.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2157 3.4436 10.7657 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 3.5720 9.2263 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4138 3.4766 9.7535 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7101 3.3361 3.4005 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8551 5.2313 2.8115 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6643 6.7688 1.2399 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1574 -2.2552 5.0762 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0864 -0.8187 5.0074 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7001 -0.1350 6.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2022 -0.8230 7.3999 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7874 -0.1536 8.5299 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3116 -2.8927 3.7472 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3185 -3.1364 3.0891 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3924 -3.1309 3.3992 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3212 -0.2019 4.3694 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0347 -0.2392 6.3008 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3367 -0.0209 6.6062 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2180 0.4653 5.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8086 0.7638 4.3644 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4045 1.9314 1.4859 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0013 4.2963 -0.1319 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3498 -2.5910 5.4942 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9076 -2.5076 5.6353 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3530 -0.6266 4.3855 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4790 -0.5213 1.5047 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1465 -1.7504 7.3727 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4585 -0.6354 9.2536 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4474 -0.5597 6.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6419 -0.2008 7.4667 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1087 0.5959 5.8952 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4023 1.1018 3.7346 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6200 2.0916 0.5643 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1608 1.5353 1.9255 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1859 2.7633 1.9131 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0657 4.5421 -1.0271 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9537 2.6217 -0.4653 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7232 6.9465 -0.0025 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0509 6.1235 -0.1361 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 2 22 1 0 0 0 0 2 1 2 0 0 0 0 3 2 1 0 0 0 0 4 24 1 0 0 0 0 5 15 1 0 0 0 0 5 13 1 0 0 0 0 6 15 1 0 0 0 0 8 11 2 0 0 0 0 9 4 1 0 0 0 0 10 14 2 0 0 0 0 11 6 1 0 0 0 0 11 7 2 0 0 0 0 12 39 1 0 0 0 0 13 42 1 0 0 0 0 13 12 2 0 0 0 0 14 5 1 0 0 0 0 15 38 2 0 0 0 0 16 11 1 0 0 0 0 16 17 1 0 0 0 0 17 27 1 0 0 0 0 18 17 2 0 0 0 0 18 28 1 0 0 0 0 19 18 1 0 0 0 0 20 16 2 0 0 0 0 21 19 1 0 0 0 0 21 29 1 0 0 0 0 23 3 1 0 0 0 0 25 4 1 0 0 0 0 26 4 1 0 0 0 0 30 45 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 6 0 0 0 31 30 1 0 0 0 0 31 32 1 0 0 0 0 32 3 2 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 1 1 0 0 0 0 34 50 1 0 0 0 0 35 30 1 0 0 0 0 36 35 2 0 0 0 0 37 35 2 0 0 0 0 38 31 1 0 0 0 0 38 12 1 0 0 0 0 39 40 2 0 0 0 0 39 51 1 0 0 0 0 40 52 1 0 0 0 0 41 53 1 0 0 0 0 41 40 1 0 0 0 0 42 41 2 0 0 0 0 43 14 1 0 0 0 0 43 57 1 0 0 0 0 43 56 1 0 0 0 0 44 20 1 0 0 0 0 44 19 2 0 0 0 0 48 6 1 0 0 0 0 49 33 1 0 0 0 0 54 42 1 0 0 0 0 55 43 1 0 0 0 0 58 44 1 0 0 0 0 59 20 1 0 0 0 0 60 21 1 0 0 0 0 61 21 1 0 0 0 0 M END > 1501905 > ? > Chen, Zhiyuan; Zheng, Danqing; Wu, Jie, (2011), A facile route to polysubstituted indoles via three-component reaction of 2-ethynylaniline, sulfonyl azide, and nitroolefin., Organic letters, 13, 5, 848-851 > https://www.crystallography.net/ > https://www.crystallography.net/cod/1501905.html $$$$