2-[3-(1,3-benzodioxol-5-yl)-6-oxidanylidene-pyridazin-1-yl]-N-(4-fluoranyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[3-(1,3-benzodioxol-5-yl)-6-oxidanylidene-pyridazin-1-yl]-N-(4-fluoranyl-3-nitro-phenyl)ethanamide Openeye Name: 2-[3-(1,3-benzodioxol-5-yl)-6-oxo-pyridazin-1-yl]-N-(4-fluoro-3-nitro-phenyl)acetamide CAS Name: 2-[3-(1,3-benzodioxol-5-yl)-6-oxo-1-pyridazinyl]-N-(4-fluoro-3-nitrophenyl)acetamide IUPAC Name: 2-[3-(1,3-benzodioxol-5-yl)-6-oxopyridazin-1-yl]-N-(4-fluoro-3-nitrophenyl)acetamide Traditional Name: 2-[3-(1,3-benzodioxol-5-yl)-6-keto-pyridazin-1-yl]-N-(4-fluoro-3-nitro-phenyl)acetamide Formula: C19H13FN4O6 MolecularWeight: 412.328123

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NN(C(=O)C=C3)CC(=O)NC4=CC(=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NN(C(=O)C=C3)CC(=O)NC4=CC(=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C19H13FN4O6/c20-13-3-2-12(8-15(13)24(27)28)21-18(25)9-23-19(26)6-4-14(22-23)11-1-5-16-17(7-11)30-10-29-16/h1-8H,9-10H2,(H,21,25)