6-(azepan-1-ylcarbonyl)-2-(4-fluorophenyl)-5-methoxy-pyridazin-3-one

Systemtic Name: 6-(azepan-1-ylcarbonyl)-2-(4-fluorophenyl)-5-methoxy-pyridazin-3-one Openeye Name: 6-(azepane-1-carbonyl)-2-(4-fluorophenyl)-5-methoxy-pyridazin-3-one CAS Name: 6-[1-azepanyl(oxo)methyl]-2-(4-fluorophenyl)-5-methoxy-3-pyridazinone IUPAC Name: 6-(azepane-1-carbonyl)-2-(4-fluorophenyl)-5-methoxypyridazin-3-one Traditional Name: 6-(azepane-1-carbonyl)-2-(4-fluorophenyl)-5-methoxy-pyridazin-3-one Formula: C18H20FN3O3 MolecularWeight: 345.368103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)N(N=C1C(=O)N2CCCCCC2)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC(=O)N(N=C1C(=O)N2CCCCCC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H20FN3O3/c1-25-15-12-16(23)22(14-8-6-13(19)7-9-14)20-17(15)18(24)21-10-4-2-3-5-11-21/h6-9,12H,2-5,10-11H2,1H3