5-[(4,5-dimethoxy-2-nitro-phenyl)methylideneamino]-4-oxidanylidene-3H-phthalazin-1-olate

Systemtic Name: 5-[(4,5-dimethoxy-2-nitro-phenyl)methylideneamino]-4-oxidanylidene-3H-phthalazin-1-olate Openeye Name: 5-[(4,5-dimethoxy-2-nitro-phenyl)methyleneamino]-4-oxo-3H-phthalazin-1-olate CAS Name: 5-[(4,5-dimethoxy-2-nitrophenyl)methylideneamino]-4-oxo-3H-phthalazin-1-olate IUPAC Name: 5-[(4,5-dimethoxy-2-nitrophenyl)methylideneamino]-4-oxo-3H-phthalazin-1-olate Traditional Name: 5-[(4,5-dimethoxy-2-nitro-benzylidene)amino]-4-keto-3H-phthalazin-1-olate Formula: C17H13N4O6- MolecularWeight: 369.30832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=NC2=CC=CC3=C2C(=O)NN=C3[O-])[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C=NC2=CC=CC3=C2C(=O)NN=C3[O-])[N+](=O)[O-])OC

InChI

InChI=1S/C17H14N4O6/c1-26-13-6-9(12(21(24)25)7-14(13)27-2)8-18-11-5-3-4-10-15(11)17(23)20-19-16(10)22/h3-8H,1-2H3,(H,19,22)(H,20,23)/p-1