(5-fluoranyl-2-nitro-phenyl) 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (5-fluoranyl-2-nitro-phenyl) 3-methyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (5-fluoro-2-nitro-phenyl) 3-methyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-methyl-4-oxo-1-phthalazinecarboxylic acid (5-fluoro-2-nitrophenyl) ester IUPAC Name: (5-fluoro-2-nitrophenyl) 3-methyl-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-methyl-phthalazine-1-carboxylic acid (5-fluoro-2-nitro-phenyl) ester Formula: C16H10FN3O5 MolecularWeight: 343.266103

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=C(C=CC(=C3)F)[N+](=O)[O-]

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=C(C=CC(=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C16H10FN3O5/c1-19-15(21)11-5-3-2-4-10(11)14(18-19)16(22)25-13-8-9(17)6-7-12(13)20(23)24/h2-8H,1H3