2-[(4-chlorophenyl)methyl]-6-(3-fluoranyl-4-methoxy-phenyl)-3-oxidanylidene-pyridazine-4-carboxylic acid

Systemtic Name: 2-[(4-chlorophenyl)methyl]-6-(3-fluoranyl-4-methoxy-phenyl)-3-oxidanylidene-pyridazine-4-carboxylic acid Openeye Name: 2-[(4-chlorophenyl)methyl]-6-(3-fluoro-4-methoxy-phenyl)-3-oxo-pyridazine-4-carboxylic acid CAS Name: 2-[(4-chlorophenyl)methyl]-6-(3-fluoro-4-methoxyphenyl)-3-oxo-4-pyridazinecarboxylic acid IUPAC Name: 2-[(4-chlorophenyl)methyl]-6-(3-fluoro-4-methoxyphenyl)-3-oxopyridazine-4-carboxylic acid Traditional Name: 2-(4-chlorobenzyl)-6-(3-fluoro-4-methoxy-phenyl)-3-keto-pyridazine-4-carboxylic acid Formula: C19H14ClFN2O4 MolecularWeight: 388.776863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C(=C2)C(=O)O)CC3=CC=C(C=C3)Cl)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C(=C2)C(=O)O)CC3=CC=C(C=C3)Cl)F

InChI

InChI=1S/C19H14ClFN2O4/c1-27-17-7-4-12(8-15(17)21)16-9-14(19(25)26)18(24)23(22-16)10-11-2-5-13(20)6-3-11/h2-9H,10H2,1H3,(H,25,26)