2-[[3-ethoxycarbonyl-1-(4-fluorophenyl)-6-oxidanylidene-pyridazin-4-yl]carbamoyl]benzoate

Systemtic Name: 2-[[3-ethoxycarbonyl-1-(4-fluorophenyl)-6-oxidanylidene-pyridazin-4-yl]carbamoyl]benzoate Openeye Name: 2-[[3-ethoxycarbonyl-1-(4-fluorophenyl)-6-oxo-pyridazin-4-yl]carbamoyl]benzoate CAS Name: 2-[[[3-ethoxycarbonyl-1-(4-fluorophenyl)-6-oxo-4-pyridazinyl]amino]-oxomethyl]benzoate IUPAC Name: 2-[[3-ethoxycarbonyl-1-(4-fluorophenyl)-6-oxopyridazin-4-yl]carbamoyl]benzoate Traditional Name: 2-[[3-carbethoxy-1-(4-fluorophenyl)-6-keto-pyridazin-4-yl]carbamoyl]benzoate Formula: C21H15FN3O6- MolecularWeight: 424.358703

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=CC=CC=C2C(=O)[O-])C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=CC=CC=C2C(=O)[O-])C3=CC=C(C=C3)F

InChI

InChI=1S/C21H16FN3O6/c1-2-31-21(30)18-16(23-19(27)14-5-3-4-6-15(14)20(28)29)11-17(26)25(24-18)13-9-7-12(22)8-10-13/h3-11H,2H2,1H3,(H,23,27)(H,28,29)/p-1