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

Systemtic Name: methyl 6-(4-fluoranyl-3-methyl-phenyl)-3-oxidanylidene-2-(phenylmethyl)pyridazine-4-carboxylate Openeye Name: methyl 2-benzyl-6-(4-fluoro-3-methyl-phenyl)-3-oxo-pyridazine-4-carboxylate CAS Name: 6-(4-fluoro-3-methylphenyl)-3-oxo-2-(phenylmethyl)-4-pyridazinecarboxylic acid methyl ester IUPAC Name: methyl 2-benzyl-6-(4-fluoro-3-methylphenyl)-3-oxopyridazine-4-carboxylate Traditional Name: 2-benzyl-6-(4-fluoro-3-methyl-phenyl)-3-keto-pyridazine-4-carboxylic acid methyl ester Formula: C20H17FN2O3 MolecularWeight: 352.358983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NN(C(=O)C(=C2)C(=O)OC)CC3=CC=CC=C3)F

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NN(C(=O)C(=C2)C(=O)OC)CC3=CC=CC=C3)F

InChI

InChI=1S/C20H17FN2O3/c1-13-10-15(8-9-17(13)21)18-11-16(20(25)26-2)19(24)23(22-18)12-14-6-4-3-5-7-14/h3-11H,12H2,1-2H3