5-(3-fluoranyl-4-methoxy-phenyl)-6-(4-methoxyphenyl)-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 5-(3-fluoranyl-4-methoxy-phenyl)-6-(4-methoxyphenyl)-2-(phenylmethyl)pyridazin-3-one Openeye Name: 2-benzyl-5-(3-fluoro-4-methoxy-phenyl)-6-(4-methoxyphenyl)pyridazin-3-one CAS Name: 5-(3-fluoro-4-methoxyphenyl)-6-(4-methoxyphenyl)-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-5-(3-fluoro-4-methoxyphenyl)-6-(4-methoxyphenyl)pyridazin-3-one Traditional Name: 2-benzyl-5-(3-fluoro-4-methoxy-phenyl)-6-(4-methoxyphenyl)pyridazin-3-one Formula: C25H21FN2O3 MolecularWeight: 416.444243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2C3=CC(=C(C=C3)OC)F)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=O)C=C2C3=CC(=C(C=C3)OC)F)CC4=CC=CC=C4

InChI

InChI=1S/C25H21FN2O3/c1-30-20-11-8-18(9-12-20)25-21(19-10-13-23(31-2)22(26)14-19)15-24(29)28(27-25)16-17-6-4-3-5-7-17/h3-15H,16H2,1-2H3