3-[[3-(3,5-dimethylphenoxy)-5-methoxy-phenyl]methyl]-1H-pyridazin-6-one

Systemtic Name: 3-[[3-(3,5-dimethylphenoxy)-5-methoxy-phenyl]methyl]-1H-pyridazin-6-one Openeye Name: 3-[[3-(3,5-dimethylphenoxy)-5-methoxy-phenyl]methyl]-1H-pyridazin-6-one CAS Name: 3-[[3-(3,5-dimethylphenoxy)-5-methoxyphenyl]methyl]-1H-pyridazin-6-one IUPAC Name: 3-[[3-(3,5-dimethylphenoxy)-5-methoxyphenyl]methyl]-1H-pyridazin-6-one Traditional Name: 3-[3-(3,5-dimethylphenoxy)-5-methoxy-benzyl]-1H-pyridazin-6-one Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=CC(=CC(=C2)CC3=NNC(=O)C=C3)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=CC(=CC(=C2)CC3=NNC(=O)C=C3)OC)C

InChI

InChI=1S/C20H20N2O3/c1-13-6-14(2)8-18(7-13)25-19-11-15(10-17(12-19)24-3)9-16-4-5-20(23)22-21-16/h4-8,10-12H,9H2,1-3H3,(H,22,23)