ethyl 4-[4-(3-chlorophenyl)piperazin-1-yl]-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-[4-(3-chlorophenyl)piperazin-1-yl]-1-(4-fluorophenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-[4-(3-chlorophenyl)piperazin-1-yl]-1-(4-fluorophenyl)-6-oxo-pyridazine-3-carboxylate CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-1-(4-fluorophenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(3-chlorophenyl)piperazin-1-yl]-1-(4-fluorophenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-1-(4-fluorophenyl)-6-keto-pyridazine-3-carboxylic acid ethyl ester Formula: C23H22ClFN4O3 MolecularWeight: 456.897183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C=C1N2CCN(CC2)C3=CC(=CC=C3)Cl)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C=C1N2CCN(CC2)C3=CC(=CC=C3)Cl)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H22ClFN4O3/c1-2-32-23(31)22-20(15-21(30)29(26-22)18-8-6-17(25)7-9-18)28-12-10-27(11-13-28)19-5-3-4-16(24)14-19/h3-9,14-15H,2,10-13H2,1H3