1-[2-[(5-nitro-2-oxidanidyl-phenyl)methylamino]-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridazin-3-olate

Systemtic Name: 1-[2-[(5-nitro-2-oxidanidyl-phenyl)methylamino]-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridazin-3-olate Openeye Name: 1-[2-[(5-nitro-2-oxido-phenyl)methylamino]-2-oxo-ethyl]-6-oxo-pyridazin-3-olate CAS Name: 1-[2-[(5-nitro-2-oxidophenyl)methylamino]-2-oxoethyl]-6-oxo-3-pyridazinolate IUPAC Name: 1-[2-[(5-nitro-2-oxidophenyl)methylamino]-2-oxoethyl]-6-oxopyridazin-3-olate Traditional Name: 6-keto-1-[2-keto-2-[(5-nitro-2-oxido-benzyl)amino]ethyl]pyridazin-3-olate Formula: C13H10N4O6-2 MolecularWeight: 318.2417

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])CNC(=O)CN2C(=O)C=CC(=N2)[O-])[O-]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])CNC(=O)CN2C(=O)C=CC(=N2)[O-])[O-]

InChI

InChI=1S/C13H12N4O6/c18-10-2-1-9(17(22)23)5-8(10)6-14-12(20)7-16-13(21)4-3-11(19)15-16/h1-5,18H,6-7H2,(H,14,20)(H,15,19)/p-2