3-[2-[2-[(4-fluoranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazin-1-olate

Systemtic Name: 3-[2-[2-[(4-fluoranyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazin-1-olate Openeye Name: 3-[2-[2-(4-fluoro-2-nitro-anilino)-2-oxo-ethoxy]-2-oxo-ethyl]-4-oxo-phthalazin-1-olate CAS Name: 3-[2-[2-(4-fluoro-2-nitroanilino)-2-oxoethoxy]-2-oxoethyl]-4-oxo-1-phthalazinolate IUPAC Name: 3-[2-[2-(4-fluoro-2-nitroanilino)-2-oxoethoxy]-2-oxoethyl]-4-oxophthalazin-1-olate Traditional Name: 3-[2-[2-(4-fluoro-2-nitro-anilino)-2-keto-ethoxy]-2-keto-ethyl]-4-keto-phthalazin-1-olate Formula: C18H12FN4O7- MolecularWeight: 415.308883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)OCC(=O)NC3=C(C=C(C=C3)F)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CC(=O)OCC(=O)NC3=C(C=C(C=C3)F)[N+](=O)[O-])[O-]

InChI

InChI=1S/C18H13FN4O7/c19-10-5-6-13(14(7-10)23(28)29)20-15(24)9-30-16(25)8-22-18(27)12-4-2-1-3-11(12)17(26)21-22/h1-7H,8-9H2,(H,20,24)(H,21,26)/p-1