2370 -OEChem-11011718543D 28 27 0 1 0 0 0 0 0999 V2000 -0.8675 0.2664 -0.3322 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 0.0047 1.1692 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 0.2234 0.0392 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8543 1.2434 -0.7503 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1822 -0.9774 -0.4767 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2521 -0.9639 0.0419 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9461 0.2229 1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3999 0.1439 -0.4533 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 1.5041 -0.4744 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -2.1287 -0.4486 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1412 0.4613 0.1243 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2063 -0.9276 -1.5722 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7088 -1.8833 -0.1539 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2421 -1.0384 1.1352 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2636 -0.7625 1.9147 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6515 0.9867 1.9047 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9506 0.4771 1.9328 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3905 0.1605 -1.5472 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9546 1.0022 -0.0622 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8392 -0.7888 -0.0872 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9818 1.3655 -1.5056 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5425 1.8555 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0937 2.2811 -0.4724 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2886 -2.0446 -1.5251 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0791 -2.1752 0.0406 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5969 -3.0817 -0.2603 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4353 1.5978 -1.6035 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8216 1.4905 -0.5706 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 11 1 0 0 0 0 2 11 2 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 11 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 6 10 1 0 0 0 0 6 14 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 8 18 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 M CHG 1 3 1 M END > DB01019 > drugbank > PUBCHEM > https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/inchikey/NZUPCNDJBJXXRF-UHFFFAOYSA-O/SDF?record_type=3d > CC(C[N+](C)(C)C)OC(N)=O > InChI=1S/C7H16N2O2/c1-6(11-7(8)10)5-9(2,3)4/h6H,5H2,1-4H3,(H-,8,10)/p+1 > NZUPCNDJBJXXRF-UHFFFAOYSA-O > C7H17N2O2 > 161.2221 > 161.129002798 > 1 > 28 > 17.7280885361127 > 1 > 1 > 1 > 0 > 1-(trimethylazaniumyl)propan-2-yl carbamate > -2.79 > -4.138114261471746 > -2.80 > 0 > 0 > 1 > 15.34062327414853 > 52.32 > 54.441 > 4 > 1 > 3.11e-01 g/l > bethanechol > 0 $$$$