methyl 2-[5-chloranyl-6-oxidanylidene-4-(4-phenylpiperazin-1-yl)pyridazin-1-yl]ethanoate

Systemtic Name: methyl 2-[5-chloranyl-6-oxidanylidene-4-(4-phenylpiperazin-1-yl)pyridazin-1-yl]ethanoate Openeye Name: methyl 2-[5-chloro-6-oxo-4-(4-phenylpiperazin-1-yl)pyridazin-1-yl]acetate CAS Name: 2-[5-chloro-6-oxo-4-(4-phenyl-1-piperazinyl)-1-pyridazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-chloro-6-oxo-4-(4-phenylpiperazin-1-yl)pyridazin-1-yl]acetate Traditional Name: 2-[5-chloro-6-keto-4-(4-phenylpiperazino)pyridazin-1-yl]acetic acid methyl ester Formula: C17H19ClN4O3 MolecularWeight: 362.81076

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(=O)C(=C(C=N1)N2CCN(CC2)C3=CC=CC=C3)Cl

Isomeric SMILES

COC(=O)CN1C(=O)C(=C(C=N1)N2CCN(CC2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C17H19ClN4O3/c1-25-15(23)12-22-17(24)16(18)14(11-19-22)21-9-7-20(8-10-21)13-5-3-2-4-6-13/h2-6,11H,7-10,12H2,1H3