4633 -OEChem-03112012563D 50 50 0 0 0 0 0 0 0999 V2000 -1.3674 0.9308 -0.1987 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2497 -0.4193 0.9026 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3658 3.2175 0.0652 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7331 -0.5658 -0.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8795 1.6679 -0.0606 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 -0.5084 -0.3853 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2012 -1.8001 -1.0252 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2599 -0.4682 0.9736 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7989 0.9241 -0.2149 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7438 -3.0241 -0.2499 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7792 -0.4577 0.9757 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0619 -2.6043 0.3559 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9009 -1.6268 0.2399 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7608 -3.9232 -0.3505 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6809 0.7338 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6925 2.0197 -0.0523 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7564 2.1461 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2913 0.8550 0.4277 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4718 1.7775 -0.0533 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9391 -4.8804 -0.2692 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4834 3.0635 -0.5328 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 2.9424 -0.5331 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8668 -0.8708 -1.3371 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8251 -1.1356 0.3932 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2881 -1.8090 -1.1578 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8034 -1.8536 -2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8776 -1.2346 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9572 0.4904 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1501 1.5450 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1468 1.3608 0.7264 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0425 -3.9199 -0.8081 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2138 -3.1161 0.7331 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6585 -3.0906 -0.1347 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1418 -0.1486 1.9626 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2074 -1.4454 0.7805 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1806 0.2535 0.2455 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2852 -2.7821 1.4153 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 -2.1450 -0.0674 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0063 -2.0467 0.7137 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6820 -1.4415 -0.8198 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5242 -3.7364 -1.4045 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8803 -4.3948 0.1012 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6878 0.0427 0.8255 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1841 -5.1131 0.7721 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7012 -5.8187 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8271 -4.4509 -0.7438 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0328 3.9767 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4779 3.7628 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3194 0.8245 0.2831 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4463 2.4287 -0.4105 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 17 1 0 0 0 0 2 13 1 0 0 0 0 2 15 1 0 0 0 0 3 17 2 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 4 8 1 0 0 0 0 5 19 1 0 0 0 0 5 49 1 0 0 0 0 5 50 1 0 0 0 0 6 9 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 10 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 11 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 20 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 18 1 0 0 0 0 15 19 2 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 16 21 1 0 0 0 0 18 43 1 0 0 0 0 19 22 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 M END > DB00892 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/CMHHMUWAYWTMGS-UHFFFAOYSA-N/SDF?record_type=3d > CCCCOC1=CC(=CC=C1N)C(=O)OCCN(CC)CC > InChI=1S/C17H28N2O3/c1-4-7-11-21-16-13-14(8-9-15(16)18)17(20)22-12-10-19(5-2)6-3/h8-9,13H,4-7,10-12,18H2,1-3H3 > CMHHMUWAYWTMGS-UHFFFAOYSA-N > C17H28N2O3 > 308.4158 > 308.209992772 > 4 > 50 > 1.9982992983653884 > 35.83146726804301 > 1 > 1 > 0 > 1 > 2-(diethylamino)ethyl 4-amino-3-butoxybenzoate > 3.30 > 3.0462850066666673 > -2.75 > 0 > 1 > 1 > 1 > 19.758059209886714 > 8.961552187278182 > 64.79 > 90.63680000000001 > 11 > 1 > 5.44e-01 g/l > oxybuprocaine > 0 $$$$