(1R,5S)-3-(1,3-benzodioxol-5-ylmethyl)-7-[4-(3-pyridinyl)phenyl]-3,6-diazabicyclo[3.1.1]heptane

Properties Image MNX_ID MNXM169752 reference chebi:125097 formula C24H23N3O2 global charge 0 mol weight 385.467 InChIKey WBGXRZPLVSELSO-SVGJNIJCSA-N InChI InChI=1S/C24H23N3O2/c1-2-19(11-25-9-1)17-4-6-18(7-5-17)24-20-13-27(14-21(24)26-20)12-16-3-8-22-23(10-16)29-15-28-22/h1-11,20-21,24,26H,12-15H2/t20-,21+,24? SMILES C1=CC(C2=CC=C(C3[C@@H]4CN(CC5=CC6=C(C=C5)OCO6)C[C@H]3N4)C=C2)=CN=C1 MNX internals InChI (mnx) InChI=1/C24H23N3O2/c1-2-19(11-25-9-1)17-4-6-18(7-5-17)24-20-13-27(14-21(24)26-20)12-16-3-8-22-23(10-16)29-15-28-22/h1-11,20-21,24,26H,12-15H2/t20-,21+,24? SMILES (mnx) [CH:1]1=[CH:2][C:19]([C:17]2=[CH:5][CH:7]=[C:18]([CH:24]3[C@@H:20]4[CH2:13][N:27]([CH2:12][C:16]5=[CH:10][C:23]6=[C:22]([CH:8]=[CH:3]5)[O:28][CH2:15][O:29]6)[CH2:14][C@H:21]3[NH:26]4)[CH:6]=[CH:4]2)=[CH:11][N:25]=[CH:9]1

Parent-child relations graph

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