6843 -OEChem-10051722093D 47 47 0 0 0 0 0 0 0999 V2000 -0.8826 0.3288 -0.0632 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8741 -1.1989 -0.6609 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2515 -1.1217 -1.4449 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4743 -0.4111 0.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 3.0825 0.4749 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2035 0.2828 0.5137 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4036 -0.1093 1.3961 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0574 -0.0384 -0.9804 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -0.3866 -0.2788 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7353 1.3727 1.4396 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3485 -0.7964 -1.2386 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4093 0.6824 -0.4012 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6873 0.1236 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2175 -0.1478 -0.7088 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4767 -1.9904 0.3608 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2383 2.0381 -0.1212 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9731 -3.4202 0.2364 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7944 0.9206 -0.0988 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6235 2.2762 0.1813 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3455 2.8350 0.1702 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5632 -4.3219 1.3058 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9057 0.2510 1.5708 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2471 1.3468 0.2467 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3181 -0.7087 1.3353 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9504 -0.4035 2.3518 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2112 1.0390 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3757 -0.3341 -1.7857 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9637 -1.4242 0.0535 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3027 -0.3827 -1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8595 2.0159 1.5612 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3127 1.7143 0.5762 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3693 1.5603 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2334 -1.8693 -1.0493 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1845 -0.4192 -0.6421 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6366 -0.6817 -2.2897 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5651 -1.9606 0.2354 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2263 -1.5975 1.3548 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2572 2.5054 -0.1353 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2177 -3.8114 -0.7584 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8785 -3.4314 0.3036 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7930 0.4900 -0.0983 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1999 3.8909 0.3838 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6550 -4.3533 1.2336 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2946 -3.9708 2.3073 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1857 -5.3429 1.1916 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6697 2.6777 0.4852 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6192 4.0650 0.6799 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 14 1 0 0 0 0 2 13 1 0 0 0 0 2 15 1 0 0 0 0 3 14 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 46 1 0 0 0 0 5 47 1 0 0 0 0 6 9 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 10 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 11 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 13 18 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 20 2 0 0 0 0 16 38 1 0 0 0 0 17 21 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 M END > DB09342 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/CAJIGINSTLKQMM-UHFFFAOYSA-N/SDF?record_type=3d > CCCOC1=CC(N)=CC=C1C(=O)OCCN(CC)CC > InChI=1S/C16H26N2O3/c1-4-10-20-15-12-13(17)7-8-14(15)16(19)21-11-9-18(5-2)6-3/h7-8,12H,4-6,9-11,17H2,1-3H3 > CAJIGINSTLKQMM-UHFFFAOYSA-N > C16H26N2O3 > 294.395 > 294.194342705 > 4 > 47 > 34.20192397705729 > 1 > 1 > 0 > 1 > 2-(diethylamino)ethyl 4-amino-2-propoxybenzoate > 2.89 > 2.601716341666667 > -2.22 > 0 > 1 > 1 > 8.961551473723942 > 64.79 > 86.03580000000001 > 10 > 1 > 1.79e+00 g/l > propoxycaine > 0 $$$$