O-[5-(hydroxynitroso)-3-(oxidonitroso)-2-oxocyclohexylidenenitroso]oxidanidolate

Properties Image MNX_ID MNXM147523 reference metacycM:CPD-17570 formula C6H5N3O7 global charge -2 mol weight 231.12 InChIKey QETMRFINVDJENM-UHFFFAOYSA-N InChI InChI=1S/C6H5N3O7/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-2H2,(H-2,10,11,12,13,14,15,16)/q-2 SMILES O=C1C(=[N+]([O-])[O-])CC(=[N+]([O-])O)CC1=[N+]([O-])[O-] MNX internals InChI (mnx) InChI=1/C6H5N3O7/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-2H2,(H-2,10,11,12,13,14,15,16)/q-2 SMILES (mnx) [CH2:1]1[C:3](=[N+:7]([O-:11])[OH:12])[CH2:2][C:5](=[N+:9]([O-:15])[O-:16])[C:6](=[O:10])[C:4]1=[N+:8]([O-:13])[O-:14]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0