(1R,2aR,8bR)-N-(2,5-difluorophenyl)-1-(hydroxymethyl)-2-(3-pyridinylmethyl)-1,2a,3,8b-tetrahydroazeto[2,3-c]quinoline-4-carboxamide

Properties Image MNX_ID MNXM169692 reference chebi:128534 formula C24H22F2N4O2 global charge 0 mol weight 436.462 InChIKey FGRNHJGXTXXJTE-RJGXRXQPSA-N InChI InChI=1S/C24H22F2N4O2/c25-16-7-8-18(26)19(10-16)28-24(32)30-13-21-23(17-5-1-2-6-20(17)30)22(14-31)29(21)12-15-4-3-9-27-11-15/h1-11,21-23,31H,12-14H2,(H,28,32)/t21-,22-,23+/m0/s1 SMILES O=C(NC1=C(F)C=CC(F)=C1)N1C[C@H]2[C@@H](C3=CC=CC=C31)[C@H](CO)N2CC1=CN=CC=C1 MNX internals InChI (mnx) InChI=1/C24H22F2N4O2/c25-16-7-8-18(26)19(10-16)28-24(32)30-13-21-23(17-5-1-2-6-20(17)30)22(14-31)29(21)12-15-4-3-9-27-11-15/h1-11,21-23,31H,12-14H2,(H,28,32)/t21-,22-,23+/m0/s1 SMILES (mnx) [CH:1]1=[CH:2][CH:6]=[C:20]2[C:17](=[CH:5]1)[C@@H:23]1[C@H:21]([CH2:13][N:30]2[C:24](=[N:28][C:19]2=[C:18]([F:26])[CH:8]=[CH:7][C:16]([F:25])=[CH:10]2)[OH:32])[N:29]([CH2:12][C:15]2=[CH:11][N:27]=[CH:9][CH:3]=[CH:4]2)[C@H:22]1[CH2:14][OH:31]

Parent-child relations graph

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