methyl 4-[[1-[(3-fluorophenyl)methyl]-6-oxidanylidene-pyridazin-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[1-[(3-fluorophenyl)methyl]-6-oxidanylidene-pyridazin-3-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[1-[(3-fluorophenyl)methyl]-6-oxo-pyridazine-3-carbonyl]amino]benzoate CAS Name: 4-[[[1-[(3-fluorophenyl)methyl]-6-oxo-3-pyridazinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-[(3-fluorophenyl)methyl]-6-oxopyridazine-3-carbonyl]amino]benzoate Traditional Name: 4-[[1-(3-fluorobenzyl)-6-keto-pyridazine-3-carbonyl]amino]benzoic acid methyl ester Formula: C20H16FN3O4 MolecularWeight: 381.357143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC3=CC(=CC=C3)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C=C2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C20H16FN3O4/c1-28-20(27)14-5-7-16(8-6-14)22-19(26)17-9-10-18(25)24(23-17)12-13-3-2-4-15(21)11-13/h2-11H,12H2,1H3,(H,22,26)