Marvin 07191011392D 34 37 0 0 0 0 999 V2000 8.6931 -3.5410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2248 -2.9138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6811 -5.1849 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9758 -3.9496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4024 -3.9604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0660 -3.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9448 -2.1390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6772 -6.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3943 -4.7804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9758 -4.7697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0364 -3.0616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2137 -2.1975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2870 -3.2855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5682 -2.4266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3760 -2.5704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5903 -1.6621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6641 -2.7421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8116 -1.9381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9607 -6.4181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9567 -7.2430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6675 -7.6537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3832 -8.0712 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1269 -7.2462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9519 -8.0712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6664 -8.4837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6664 -9.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9519 -9.7212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2374 -8.4837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2374 -9.3087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7144 -7.9606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7143 -6.5316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8893 -7.9606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8893 -6.5317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4768 -7.2462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 4 1 1 0 0 0 0 5 1 1 0 0 0 0 6 1 1 0 0 0 0 7 2 2 0 0 0 0 11 2 1 0 0 0 0 9 3 1 0 0 0 0 8 3 1 0 0 0 0 10 3 1 0 0 0 0 10 4 1 0 0 0 0 9 5 1 0 0 0 0 12 6 2 0 0 0 0 13 6 1 0 0 0 0 14 11 1 0 0 0 0 16 12 1 0 0 0 0 17 13 2 0 0 0 0 15 14 1 0 0 0 0 18 16 2 0 0 0 0 18 17 1 0 0 0 0 8 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 3 0 0 0 0 20 23 1 0 0 0 0 20 24 1 0 0 0 0 26 25 1 0 0 0 0 24 25 2 0 0 0 0 27 26 2 0 0 0 0 28 24 1 0 0 0 0 29 27 1 0 0 0 0 29 28 2 0 0 0 0 30 23 1 0 0 0 0 31 23 2 0 0 0 0 32 30 2 0 0 0 0 33 31 1 0 0 0 0 34 32 1 0 0 0 0 34 33 2 0 0 0 0 M END > CHEBI:4639 > diphenoxylate > A piperidinecarboxylate ester that is the ethyl ester of difenoxin. > 3 > ethyl 1-(3-cyano-3,3-diphenylpropyl)-4-phenylisonipecotate; ethyl 1-(3-cyano-3,3-diphenylpropyl)-4-phenyl-4-piperidinecarboxylate; 4-ethoxycarbonyl-alpha,alpha,4-triphenyl-1-piperidinebutyronitrile; 2,2-diphenyl-4-(4-carbethoxy-4-phenylpiperidino)butyronitrile; 1-(3-cyano-3,3-diphenylpropyl)-4-phenyl-isonipecotic acid ethyl ester > ethyl 1-(3-cyano-3,3-diphenylpropyl)-4-phenylpiperidine-4-carboxylate > diphenoxylatum; diphenoxylate; difenoxilato > C30H32N2O2 > 452.58730 > 452.24638 > 0 > CCOC(=O)C1(CCN(CC1)CCC(C#N)(c1ccccc1)c1ccccc1)c1ccccc1 > InChI=1S/C30H32N2O2/c1-2-34-28(33)29(25-12-6-3-7-13-25)18-21-32(22-19-29)23-20-30(24-31,26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-17H,2,18-23H2,1H3 > HYPPXZBJBPSRLK-UHFFFAOYSA-N > 503374 > 915-30-0 > 503374 > 915-30-0 > DB01081 > C07872 > D07861 > LSM-5534 > 915-30-0 > Diphenoxylate $$$$