ethyl 3-[[1-[(4-fluorophenyl)methyl]-6-oxidanylidene-4,5-dihydropyridazin-3-yl]carbonylamino]benzoate

Systemtic Name: ethyl 3-[[1-[(4-fluorophenyl)methyl]-6-oxidanylidene-4,5-dihydropyridazin-3-yl]carbonylamino]benzoate Openeye Name: ethyl 3-[[1-[(4-fluorophenyl)methyl]-6-oxo-4,5-dihydropyridazine-3-carbonyl]amino]benzoate CAS Name: 3-[[[1-[(4-fluorophenyl)methyl]-6-oxo-4,5-dihydropyridazin-3-yl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[1-[(4-fluorophenyl)methyl]-6-oxo-4,5-dihydropyridazine-3-carbonyl]amino]benzoate Traditional Name: 3-[[1-(4-fluorobenzyl)-6-keto-4,5-dihydropyridazine-3-carbonyl]amino]benzoic acid ethyl ester Formula: C21H20FN3O4 MolecularWeight: 397.399603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=NN(C(=O)CC2)CC3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=NN(C(=O)CC2)CC3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FN3O4/c1-2-29-21(28)15-4-3-5-17(12-15)23-20(27)18-10-11-19(26)25(24-18)13-14-6-8-16(22)9-7-14/h3-9,12H,2,10-11,13H2,1H3,(H,23,27)