3-(4-nitrophenyl)-4-oxidanylidene-phthalazin-1-olate

Systemtic Name: 3-(4-nitrophenyl)-4-oxidanylidene-phthalazin-1-olate Openeye Name: 3-(4-nitrophenyl)-4-oxo-phthalazin-1-olate CAS Name: 3-(4-nitrophenyl)-4-oxo-1-phthalazinolate IUPAC Name: 3-(4-nitrophenyl)-4-oxophthalazin-1-olate Traditional Name: 4-keto-3-(4-nitrophenyl)phthalazin-1-olate Formula: C14H8N3O4- MolecularWeight: 282.23102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)C3=CC=C(C=C3)[N+](=O)[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)/p-1