N-(4-fluoranyl-3-nitro-phenyl)-4-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]butanamide

Systemtic Name: N-(4-fluoranyl-3-nitro-phenyl)-4-[3-(4-methoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]butanamide Openeye Name: N-(4-fluoro-3-nitro-phenyl)-4-[3-(4-methoxyphenyl)-6-oxo-pyridazin-1-yl]butanamide CAS Name: N-(4-fluoro-3-nitrophenyl)-4-[3-(4-methoxyphenyl)-6-oxo-1-pyridazinyl]butanamide IUPAC Name: N-(4-fluoro-3-nitrophenyl)-4-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]butanamide Traditional Name: N-(4-fluoro-3-nitro-phenyl)-4-[6-keto-3-(4-methoxyphenyl)pyridazin-1-yl]butyramide Formula: C21H19FN4O5 MolecularWeight: 426.397763

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C21H19FN4O5/c1-31-16-7-4-14(5-8-16)18-10-11-21(28)25(24-18)12-2-3-20(27)23-15-6-9-17(22)19(13-15)26(29)30/h4-11,13H,2-3,12H2,1H3,(H,23,27)