3-(4-nitrophenyl)-2H-phthalazine-1,4-dione

Systemtic Name: 3-(4-nitrophenyl)-2H-phthalazine-1,4-dione Openeye Name: 3-(4-nitrophenyl)-2H-phthalazine-1,4-dione CAS Name: 3-(4-nitrophenyl)-2H-phthalazine-1,4-dione IUPAC Name: 3-(4-nitrophenyl)-2H-phthalazine-1,4-dione Traditional Name: 3-(4-nitrophenyl)-2H-phthalazine-1,4-quinone Formula: C14H9N3O4 MolecularWeight: 283.23896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H9N3O4/c18-13-11-3-1-2-4-12(11)14(19)16(15-13)9-5-7-10(8-6-9)17(20)21/h1-8H,(H,15,18)