methyl 2-[2-(4-nitrophenyl)carbonyl-5-oxidanylidene-3-phenyl-1,6-dihydropyridazin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-(4-nitrophenyl)carbonyl-5-oxidanylidene-3-phenyl-1,6-dihydropyridazin-6-yl]ethanoate Openeye Name: methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate CAS Name: 2-[2-[(4-nitrophenyl)-oxomethyl]-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(4-nitrobenzoyl)-5-oxo-3-phenyl-1,6-dihydropyridazin-6-yl]acetate Traditional Name: 2-[5-keto-2-(4-nitrobenzoyl)-3-phenyl-1,6-dihydropyridazin-6-yl]acetic acid methyl ester Formula: C20H17N3O6 MolecularWeight: 395.36548

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)C=C(N(N1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

COC(=O)CC1C(=O)C=C(N(N1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C20H17N3O6/c1-29-19(25)11-16-18(24)12-17(13-5-3-2-4-6-13)22(21-16)20(26)14-7-9-15(10-8-14)23(27)28/h2-10,12,16,21H,11H2,1H3