HMDB0036906 RDKit 3D Butyl 2-aminobenzoate 29 29 0 0 0 0 0 0 0 0999 V2000 4.6917 -1.0111 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8261 0.1606 -0.2032 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3754 -0.1205 0.1235 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5535 1.0497 -0.3337 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 0.8960 -0.0782 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6003 -0.1111 -0.5766 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -0.9626 -1.3138 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0378 -0.2426 -0.2897 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7882 -1.2683 -0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1327 -1.3458 -0.5079 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7558 -0.4139 0.3066 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9627 0.6007 0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6296 0.6953 0.5208 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8696 1.7576 1.0621 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4895 -1.8591 -0.4463 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7503 -0.6993 0.2372 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3355 -1.3340 1.2495 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9115 0.2419 -1.3106 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2064 1.0796 0.2726 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2886 -0.1480 1.2476 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1025 -1.0655 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6864 1.1595 -1.4293 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9467 1.9735 0.1319 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2985 -2.0113 -1.4556 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7448 -2.1498 -0.9078 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8113 -0.4926 0.5298 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4766 1.3331 1.4525 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4093 2.5048 0.5401 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7653 1.7834 2.1176 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 13 8 1 0 1 15 1 0 1 16 1 0 1 17 1 0 2 18 1 0 2 19 1 0 3 20 1 0 3 21 1 0 4 22 1 0 4 23 1 0 9 24 1 0 10 25 1 0 11 26 1 0 12 27 1 0 14 28 1 0 14 29 1 0 M END