methyl 4-[[[1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-pyridazin-3-yl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-pyridazin-3-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[1-(2-fluorophenyl)-6-methyl-4-oxo-pyridazine-3-carbonyl]amino]methyl]benzoate CAS Name: 4-[[[[1-(2-fluorophenyl)-6-methyl-4-oxo-3-pyridazinyl]-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[1-(2-fluorophenyl)-6-methyl-4-oxopyridazine-3-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[[1-(2-fluorophenyl)-4-keto-6-methyl-pyridazine-3-carbonyl]amino]methyl]benzoic acid methyl ester Formula: C21H18FN3O4 MolecularWeight: 395.383723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H18FN3O4/c1-13-11-18(26)19(24-25(13)17-6-4-3-5-16(17)22)20(27)23-12-14-7-9-15(10-8-14)21(28)29-2/h3-11H,12H2,1-2H3,(H,23,27)