2-[3-(3,4-dimethylphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(4-fluoranyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[3-(3,4-dimethylphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(4-fluoranyl-3-nitro-phenyl)ethanamide Openeye Name: 2-[3-(3,4-dimethylphenyl)-6-oxo-pyridazin-1-yl]-N-(4-fluoro-3-nitro-phenyl)acetamide CAS Name: 2-[3-(3,4-dimethylphenyl)-6-oxo-1-pyridazinyl]-N-(4-fluoro-3-nitrophenyl)acetamide IUPAC Name: 2-[3-(3,4-dimethylphenyl)-6-oxopyridazin-1-yl]-N-(4-fluoro-3-nitrophenyl)acetamide Traditional Name: 2-[3-(3,4-dimethylphenyl)-6-keto-pyridazin-1-yl]-N-(4-fluoro-3-nitro-phenyl)acetamide Formula: C20H17FN4O4 MolecularWeight: 396.371783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-])C

InChI

InChI=1S/C20H17FN4O4/c1-12-3-4-14(9-13(12)2)17-7-8-20(27)24(23-17)11-19(26)22-15-5-6-16(21)18(10-15)25(28)29/h3-10H,11H2,1-2H3,(H,22,26)