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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19FN4O5/c1-31-16-5-2-4-14(12-16)18-9-10-21(28)25(24-18)11-3-6-20(27)23-15-7-8-17(22)19(13-15)26(29)30/h2,4-5,7-10,12-13H,3,6,11H2,1H3,(H,23,27)