(4-nitrophenyl) 3-(4-methoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (4-nitrophenyl) 3-(4-methoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (4-nitrophenyl) 3-(4-methoxyphenyl)-4-oxo-phthalazine-1-carboxylate CAS Name: 3-(4-methoxyphenyl)-4-oxo-1-phthalazinecarboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 3-(4-methoxyphenyl)-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-(4-methoxyphenyl)phthalazine-1-carboxylic acid (4-nitrophenyl) ester Formula: C22H15N3O6 MolecularWeight: 417.371

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)OC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)OC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H15N3O6/c1-30-16-10-6-14(7-11-16)24-21(26)19-5-3-2-4-18(19)20(23-24)22(27)31-17-12-8-15(9-13-17)25(28)29/h2-13H,1H3