methyl 6-(3-fluoranyl-4-methoxy-phenyl)-2-(2-methylpropyl)-3-oxidanylidene-pyridazine-4-carboxylate

Systemtic Name: methyl 6-(3-fluoranyl-4-methoxy-phenyl)-2-(2-methylpropyl)-3-oxidanylidene-pyridazine-4-carboxylate Openeye Name: methyl 6-(3-fluoro-4-methoxy-phenyl)-2-isobutyl-3-oxo-pyridazine-4-carboxylate CAS Name: 6-(3-fluoro-4-methoxyphenyl)-2-(2-methylpropyl)-3-oxo-4-pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 6-(3-fluoro-4-methoxyphenyl)-2-(2-methylpropyl)-3-oxopyridazine-4-carboxylate Traditional Name: 6-(3-fluoro-4-methoxy-phenyl)-2-isobutyl-3-keto-pyridazine-4-carboxylic acid methyl ester Formula: C17H19FN2O4 MolecularWeight: 334.342163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C(=CC(=N1)C2=CC(=C(C=C2)OC)F)C(=O)OC

Isomeric SMILES

CC(C)CN1C(=O)C(=CC(=N1)C2=CC(=C(C=C2)OC)F)C(=O)OC

InChI

InChI=1S/C17H19FN2O4/c1-10(2)9-20-16(21)12(17(22)24-4)8-14(19-20)11-5-6-15(23-3)13(18)7-11/h5-8,10H,9H2,1-4H3