ethyl 4-[(2,3-dimethoxyphenyl)carbonylamino]-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[(2,3-dimethoxyphenyl)carbonylamino]-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[(2,3-dimethoxybenzoyl)amino]-1-(4-fluorophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 4-[[(2,3-dimethoxyphenyl)-oxomethyl]amino]-1-(4-fluorophenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2,3-dimethoxybenzoyl)amino]-1-(4-fluorophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-6-keto-4-(o-veratroylamino)pyridazine-3-carboxylic acid ethyl ester Formula: C22H20FN3O6 MolecularWeight: 441.409103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=C(C(=CC=C2)OC)OC)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)C2=C(C(=CC=C2)OC)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H20FN3O6/c1-4-32-22(29)19-16(12-18(27)26(25-19)14-10-8-13(23)9-11-14)24-21(28)15-6-5-7-17(30-2)20(15)31-3/h5-12H,4H2,1-3H3,(H,24,28)