N-[(E)-(3-nitrophenyl)methylideneamino]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide

Systemtic Name: N-[(E)-(3-nitrophenyl)methylideneamino]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide Openeye Name: N-[(E)-(3-nitrophenyl)methyleneamino]-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: N-[(E)-(3-nitrophenyl)methylideneamino]-2-(4-oxo-3H-phthalazin-1-yl)acetamide IUPAC Name: N-[(E)-(3-nitrophenyl)methylideneamino]-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)-N-[(E)-(3-nitrobenzylidene)amino]acetamide Formula: C17H13N5O4 MolecularWeight: 351.31622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NN=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)N/N=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N5O4/c23-16(20-18-10-11-4-3-5-12(8-11)22(25)26)9-15-13-6-1-2-7-14(13)17(24)21-19-15/h1-8,10H,9H2,(H,20,23)(H,21,24)/b18-10+