(2S,3R,4R)-3-[4-[2-(2-fluorophenyl)ethynyl]phenyl]-4-(hydroxymethyl)-2-azetidinecarbonitrile

Properties Image MNX_ID MNXM171414 reference chebi:100326 formula C19H15FN2O global charge 0 mol weight 306.34 InChIKey BQRBXGWYUGGWQF-CEXWTWQISA-N InChI InChI=1S/C19H15FN2O/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23/h1-4,6-7,9-10,17-19,22-23H,12H2/t17-,18+,19-/m1/s1 SMILES N#C[C@H]1N[C@@H](CO)[C@@H]1C1=CC=C(C#CC2=CC=CC=C2F)C=C1 MNX internals InChI (mnx) InChI=1/C19H15FN2O/c20-16-4-2-1-3-14(16)8-5-13-6-9-15(10-7-13)19-17(11-21)22-18(19)12-23/h1-4,6-7,9-10,17-19,22-23H,12H2/t17-,18+,19-/m1/s1 SMILES (mnx) [CH:1]1=[CH:2][CH:4]=[C:16]([F:20])[C:14]([C:8]#[C:5][C:13]2=[CH:7][CH:10]=[C:15]([C@@H:19]3[C@@H:17]([C:11]#[N:21])[NH:22][C@H:18]3[CH2:12][OH:23])[CH:9]=[CH:6]2)=[CH:3]1

Parent-child relations graph

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