4-(4-azanyl-3-nitro-phenyl)-2H-phthalazin-1-one

Systemtic Name: 4-(4-azanyl-3-nitro-phenyl)-2H-phthalazin-1-one Openeye Name: 4-(4-amino-3-nitro-phenyl)-2H-phthalazin-1-one CAS Name: 4-(4-amino-3-nitrophenyl)-2H-phthalazin-1-one IUPAC Name: 4-(4-amino-3-nitrophenyl)-2H-phthalazin-1-one Traditional Name: 4-(4-amino-3-nitro-phenyl)-2H-phthalazin-1-one Formula: C14H10N4O3 MolecularWeight: 282.2542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10N4O3/c15-11-6-5-8(7-12(11)18(20)21)13-9-3-1-2-4-10(9)14(19)17-16-13/h1-7H,15H2,(H,17,19)