ethyl 1-(4-fluorophenyl)-4-[(4-methoxyphenyl)methylamino]-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 1-(4-fluorophenyl)-4-[(4-methoxyphenyl)methylamino]-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 1-(4-fluorophenyl)-4-[(4-methoxyphenyl)methylamino]-6-oxo-pyridazine-3-carboxylate CAS Name: 1-(4-fluorophenyl)-4-[(4-methoxyphenyl)methylamino]-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-fluorophenyl)-4-[(4-methoxyphenyl)methylamino]-6-oxopyridazine-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-6-keto-4-(p-anisylamino)pyridazine-3-carboxylic acid ethyl ester Formula: C21H20FN3O4 MolecularWeight: 397.399603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NCC2=CC=C(C=C2)OC)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NCC2=CC=C(C=C2)OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H20FN3O4/c1-3-29-21(27)20-18(23-13-14-4-10-17(28-2)11-5-14)12-19(26)25(24-20)16-8-6-15(22)7-9-16/h4-12,23H,3,13H2,1-2H3