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

Systemtic Name: ethyl 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-oxidanylidene-1-phenyl-pyridazine-3-carboxylate Openeye Name: ethyl 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-oxo-1-phenyl-pyridazine-3-carboxylate CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-6-oxo-1-phenyl-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-oxo-1-phenylpyridazine-3-carboxylate Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-6-keto-1-phenyl-pyridazine-3-carboxylic acid ethyl ester Formula: C23H23ClN4O3 MolecularWeight: 438.90672

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C23H23ClN4O3/c1-2-31-23(30)22-20(16-21(29)28(25-22)18-8-4-3-5-9-18)27-13-11-26(12-14-27)19-10-6-7-17(24)15-19/h3-10,15-16H,2,11-14H2,1H3