compound 0041216

Properties Image MNX_ID MNXM503551 reference envipathM:...1f23dd10fc56 formula C18H16F3NO4 global charge 0 mol weight 367.323 InChIKey YAIKWKCGOOQIIX-UHFFFAOYSA-N InChI InChI=1S/C18H16F3NO4/c1-22-15-14(11-7-12(18(19,20)21)9-13(23)8-11)16(24)26-17(25-15)10-5-3-2-4-6-10/h2-9,14-15,17,22-23H,1H3 SMILES CNC1OC(C2=CC=CC=C2)OC(=O)C1C1=CC(O)=CC(C(F)(F)F)=C1 MNX internals InChI (mnx) InChI=1/C18H16F3NO4/c1-22-15-14(11-7-12(18(19,20)21)9-13(23)8-11)16(24)26-17(25-15)10-5-3-2-4-6-10/h2-9,14-15,17,22-23H,1H3/t14?,15?,17? SMILES (mnx) [CH3:1][NH:22][CH:15]1[CH:14]([C:11]2=[CH:7][C:12]([C:18]([F:19])([F:20])[F:21])=[CH:9][C:13]([OH:23])=[CH:8]2)[C:16](=[O:24])[O:26][CH:17]([C:10]2=[CH:5][CH:3]=[CH:2][CH:4]=[CH:6]2)[O:25]1

Parent-child relations graph

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