5-acetylamino-2-nitrobenzoic acid

Properties Image MNX_ID MNXM151348 reference chebi:86569 formula C9H8N2O5 global charge 0 mol weight 224.172 InChIKey ZSHFMOUMOUOGKI-UHFFFAOYSA-N InChI InChI=1S/C9H8N2O5/c1-5(12)10-6-2-3-8(11(15)16)7(4-6)9(13)14/h2-4H,1H3,(H,10,12)(H,13,14) SMILES CC(=O)NC1=CC(C(=O)O)=C([N+](=O)[O-])C=C1 MNX internals InChI (mnx) InChI=1/C9H8N2O5/c1-5(12)10-6-2-3-8(11(15)16)7(4-6)9(13)14/h2-4H,1H3,(H,10,12)(H,13,14) SMILES (mnx) [CH3:1][C:5](=[N:10][C:6]1=[CH:4][C:7]([C:9](=[O:13])[OH:14])=[C:8]([N+:11]([O-:15])=[O:16])[CH:3]=[CH:2]1)[OH:12]

Parent-child relations graph

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