ethyl 4-[1-(4-fluorophenyl)-4-methoxy-6-oxidanylidene-pyridazin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-(4-fluorophenyl)-4-methoxy-6-oxidanylidene-pyridazin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[1-(4-fluorophenyl)-4-methoxy-6-oxo-pyridazine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-(4-fluorophenyl)-4-methoxy-6-oxo-3-pyridazinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(4-fluorophenyl)-4-methoxy-6-oxopyridazine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-(4-fluorophenyl)-6-keto-4-methoxy-pyridazine-3-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H21FN4O5 MolecularWeight: 404.392243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=NN(C(=O)C=C2OC)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=NN(C(=O)C=C2OC)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H21FN4O5/c1-3-29-19(27)23-10-8-22(9-11-23)18(26)17-15(28-2)12-16(25)24(21-17)14-6-4-13(20)5-7-14/h4-7,12H,3,8-11H2,1-2H3