(1R)-N-(2-fluorophenyl)-1'-[(2-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-7-methoxy-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide

Properties Image MNX_ID MNXM169627 reference chebi:128000 formula C29H26F2N4O4 global charge 0 mol weight 532.547 InChIKey CNJMUKHVAPJYSK-DEOSSOPVSA-N InChI InChI=1S/C29H26F2N4O4/c1-39-17-10-11-19-23(12-17)32-26-24(13-36)35(28(38)33-22-9-5-4-8-21(22)31)16-29(25(19)26)14-34(15-29)27(37)18-6-2-3-7-20(18)30/h2-12,24,32,36H,13-16H2,1H3,(H,33,38)/t24-/m0/s1 SMILES COC1=CC2=C(C=C1)C1=C(N2)[C@H](CO)N(C(=O)NC2=CC=CC=C2F)CC12CN(C(=O)C1=CC=CC=C1F)C2 MNX internals InChI (mnx) InChI=1/C29H26F2N4O4/c1-39-17-10-11-19-23(12-17)32-26-24(13-36)35(28(38)33-22-9-5-4-8-21(22)31)16-29(25(19)26)14-34(15-29)27(37)18-6-2-3-7-20(18)30/h2-12,24,32,36H,13-16H2,1H3,(H,33,38)/t24-/m0/s1 SMILES (mnx) [CH3:1][O:39][C:17]1=[CH:12][C:23]2=[C:19]([CH:11]=[CH:10]1)[C:25]1=[C:26]([C@H:24]([CH2:13][OH:36])[N:35]([C:28](=[N:33][C:22]3=[CH:9][CH:5]=[CH:4][CH:8]=[C:21]3[F:31])[OH:38])[CH2:16][C:29]13[CH2:14][N:34]([C:27]([C:18]1=[CH:6][CH:2]=[CH:3][CH:7]=[C:20]1[F:30])=[O:37])[CH2:15]3)[NH:32]2

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0