6-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]carbonylpyridazin-3-olate

Systemtic Name: 6-[4-[(5-fluoranyl-2-methoxy-phenyl)methyl]piperazin-1-yl]carbonylpyridazin-3-olate Openeye Name: 6-[4-[(5-fluoro-2-methoxy-phenyl)methyl]piperazine-1-carbonyl]pyridazin-3-olate CAS Name: 6-[[4-[(5-fluoro-2-methoxyphenyl)methyl]-1-piperazinyl]-oxomethyl]-3-pyridazinolate IUPAC Name: 6-[4-[(5-fluoro-2-methoxyphenyl)methyl]piperazine-1-carbonyl]pyridazin-3-olate Traditional Name: 6-[4-(5-fluoro-2-methoxy-benzyl)piperazine-1-carbonyl]pyridazin-3-olate Formula: C17H18FN4O3- MolecularWeight: 345.348223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)CN2CCN(CC2)C(=O)C3=NN=C(C=C3)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)F)CN2CCN(CC2)C(=O)C3=NN=C(C=C3)[O-]

InChI

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