ethyl 1-(4-fluorophenyl)-4-(2-methylpropanoylamino)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(4-fluorophenyl)-4-(2-methylpropanoylamino)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 1-(4-fluorophenyl)-4-(2-methylpropanoylamino)-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(4-fluorophenyl)-4-[(2-methyl-1-oxopropyl)amino]-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-fluorophenyl)-4-(2-methylpropanoylamino)-6-oxopyridazine-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-4-(isobutyrylamino)-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C17H18FN3O4 MolecularWeight: 347.340923

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C(C)C)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C(C)C)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H18FN3O4/c1-4-25-17(24)15-13(19-16(23)10(2)3)9-14(22)21(20-15)12-7-5-11(18)6-8-12/h5-10H,4H2,1-3H3,(H,19,23)