Marvin 01111009332D 19 20 0 0 1 0 999 V2000 -0.0584 0.8601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7724 0.4467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6639 0.4509 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.4864 0.8601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6639 -0.3758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3778 0.8643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 0.8726 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7724 -0.3883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 0.4592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4906 1.6868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2004 0.4467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3821 -0.7808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0459 -0.7891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 0.4592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4864 -0.8017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3904 -1.6075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2004 -0.3883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0459 -1.6158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6681 -2.0292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 1 1 0 0 0 0 4 2 2 0 0 0 0 3 5 1 6 0 0 0 6 3 1 0 0 0 0 7 9 1 0 0 0 0 8 2 1 0 0 0 0 9 6 1 0 0 0 0 10 4 1 0 0 0 0 11 4 1 0 0 0 0 12 5 1 0 0 0 0 13 5 2 0 0 0 0 14 7 1 0 0 0 0 15 8 2 0 0 0 0 16 12 2 0 0 0 0 17 15 1 0 0 0 0 18 13 1 0 0 0 0 19 18 2 0 0 0 0 11 17 2 0 0 0 0 16 19 1 0 0 0 0 M END > CHEBI:127342 > atomoxetine > A secondary amino compound having methyl and 3-(2-methylphenoxy)-3-phenylpropan-1-yl substituents. > 3 > Tomoxetinum; Tomoxetina; (-)-Tomoxetine > (3R)-N-methyl-3-(2-methylphenoxy)-3-phenylpropan-1-amine > tomoxetine; atomoxetine > C17H21NO > 255.35470 > 255.16231 > 0 > CNCC[C@@H](Oc1ccccc1C)c1ccccc1 > InChI=1S/C17H21NO/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15/h3-11,17-18H,12-13H2,1-2H3/t17-/m1/s1 > VHGCDTVCOLNTBX-QGZVFWFLSA-N > 4318684 > 83015-26-3 > 4318684 > 83015-26-3 > DB00289 > D07473 > LSM-2452 > Atomoxetine > 15338851; 23048018 $$$$