ethyl 4-[2-(4-chloranylphenoxy)ethanoylamino]-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[2-(4-chloranylphenoxy)ethanoylamino]-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[[2-(4-chlorophenoxy)acetyl]amino]-1-(4-fluorophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 4-[[2-(4-chlorophenoxy)-1-oxoethyl]amino]-1-(4-fluorophenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-chlorophenoxy)acetyl]amino]-1-(4-fluorophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-[[2-(4-chlorophenoxy)acetyl]amino]-1-(4-fluorophenyl)-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C21H17ClFN3O5 MolecularWeight: 445.828183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)COC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1NC(=O)COC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H17ClFN3O5/c1-2-30-21(29)20-17(24-18(27)12-31-16-9-3-13(22)4-10-16)11-19(28)26(25-20)15-7-5-14(23)6-8-15/h3-11H,2,12H2,1H3,(H,24,27)