ethyl 4-[(4-ethoxy-4-oxidanylidene-butanoyl)amino]-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[(4-ethoxy-4-oxidanylidene-butanoyl)amino]-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[(4-ethoxy-4-oxo-butanoyl)amino]-1-(4-fluorophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 4-[(4-ethoxy-1,4-dioxobutyl)amino]-1-(4-fluorophenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-ethoxy-4-oxobutanoyl)amino]-1-(4-fluorophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-[(4-ethoxy-4-keto-butanoyl)amino]-1-(4-fluorophenyl)-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C19H20FN3O6 MolecularWeight: 405.377003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=CC(=O)N(N=C1C(=O)OCC)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=CC(=O)N(N=C1C(=O)OCC)C2=CC=C(C=C2)F

InChI

InChI=1S/C19H20FN3O6/c1-3-28-17(26)10-9-15(24)21-14-11-16(25)23(13-7-5-12(20)6-8-13)22-18(14)19(27)29-4-2/h5-8,11H,3-4,9-10H2,1-2H3,(H,21,24)