2,4-Dinitrobenzoate

Properties Image MNX_ID MNXM165617 reference sabiorkM:20901 formula C7H3N2O6 global charge -1 mol weight 211.109 InChIKey ZIIGSRYPZWDGBT-UHFFFAOYSA-M InChI InChI=1S/C7H4N2O6/c10-7(11)5-2-1-4(8(12)13)3-6(5)9(14)15/h1-3H,(H,10,11)/p-1 SMILES O=C([O-])C1=C([N+](=O)[O-])C=C([N+](=O)[O-])C=C1 MNX internals InChI (mnx) InChI=1/C7H4N2O6/c10-7(11)5-2-1-4(8(12)13)3-6(5)9(14)15/h1-3H,(H,10,11) SMILES (mnx) [CH:1]1=[CH:2][C:5]([C:7](=[O:10])[OH:11])=[C:6]([N+:9]([O-:14])=[O:15])[CH:3]=[C:4]1[N+:8]([O-:12])=[O:13]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 0