1-[(3-fluoranyl-4-methoxy-phenyl)methyl]-6-oxidanylidene-4,5-dihydropyridazine-3-carboxylic acid

Systemtic Name: 1-[(3-fluoranyl-4-methoxy-phenyl)methyl]-6-oxidanylidene-4,5-dihydropyridazine-3-carboxylic acid Openeye Name: 1-[(3-fluoro-4-methoxy-phenyl)methyl]-6-oxo-4,5-dihydropyridazine-3-carboxylic acid CAS Name: 1-[(3-fluoro-4-methoxyphenyl)methyl]-6-oxo-4,5-dihydropyridazine-3-carboxylic acid IUPAC Name: 1-[(3-fluoro-4-methoxyphenyl)methyl]-6-oxo-4,5-dihydropyridazine-3-carboxylic acid Traditional Name: 1-(3-fluoro-4-methoxy-benzyl)-6-keto-4,5-dihydropyridazine-3-carboxylic acid Formula: C13H13FN2O4 MolecularWeight: 280.251723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=O)CCC(=N2)C(=O)O)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=O)CCC(=N2)C(=O)O)F

InChI

InChI=1S/C13H13FN2O4/c1-20-11-4-2-8(6-9(11)14)7-16-12(17)5-3-10(15-16)13(18)19/h2,4,6H,3,5,7H2,1H3,(H,18,19)