compound 0003973

Properties Image MNX_ID MNXM1137818 reference envipathM:...33fc8780db1f formula C11H7ClF3N3O3 global charge 0 mol weight 321.642 InChIKey LCCVXGGZRNCCCM-UHFFFAOYSA-N InChI InChI=1S/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20) SMILES CC1=NN(C2=CC(C(=O)O)=C(Cl)C=C2F)C(=O)N1C(F)F MNX internals InChI (mnx) InChI=1/C11H7ClF3N3O3/c1-4-16-18(11(21)17(4)10(14)15)8-2-5(9(19)20)6(12)3-7(8)13/h2-3,10H,1H3,(H,19,20) SMILES (mnx) [CH3:1][C:4]1=[N:16][N:18]([C:8]2=[C:7]([F:13])[CH:3]=[C:6]([Cl:12])[C:5]([C:9](=[O:19])[OH:20])=[CH:2]2)[C:11](=[O:21])[N:17]1[CH:10]([F:14])[F:15]

Parent-child relations graph

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