methyl 2-[3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxidanylidene-pyridazin-1-yl]ethanoate

Systemtic Name: methyl 2-[3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxidanylidene-pyridazin-1-yl]ethanoate Openeye Name: methyl 2-[3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxo-pyridazin-1-yl]acetate CAS Name: 2-[3-[4-(4-fluorophenyl)-1-piperazinyl]-6-oxo-1-pyridazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxopyridazin-1-yl]acetate Traditional Name: 2-[3-[4-(4-fluorophenyl)piperazino]-6-keto-pyridazin-1-yl]acetic acid methyl ester Formula: C17H19FN4O3 MolecularWeight: 346.356163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19FN4O3/c1-25-17(24)12-22-16(23)7-6-15(19-22)21-10-8-20(9-11-21)14-4-2-13(18)3-5-14/h2-7H,8-12H2,1H3