3-[[7-(2,4-dichlorophenyl)carbonyl-1-benzofuran-5-yl]methyl]-1H-pyridazin-6-one

Systemtic Name: 3-[[7-(2,4-dichlorophenyl)carbonyl-1-benzofuran-5-yl]methyl]-1H-pyridazin-6-one Openeye Name: 3-[[7-(2,4-dichlorobenzoyl)benzofuran-5-yl]methyl]-1H-pyridazin-6-one CAS Name: 3-[[7-[(2,4-dichlorophenyl)-oxomethyl]-5-benzofuranyl]methyl]-1H-pyridazin-6-one IUPAC Name: 3-[[7-(2,4-dichlorobenzoyl)-1-benzofuran-5-yl]methyl]-1H-pyridazin-6-one Traditional Name: 3-[[7-(2,4-dichlorobenzoyl)benzofuran-5-yl]methyl]-1H-pyridazin-6-one Formula: C20H12Cl2N2O3 MolecularWeight: 399.22688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)C(=O)C2=C3C(=CC(=C2)CC4=NNC(=O)C=C4)C=CO3

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)C(=O)C2=C3C(=CC(=C2)CC4=NNC(=O)C=C4)C=CO3

InChI

InChI=1S/C20H12Cl2N2O3/c21-13-1-3-15(17(22)10-13)19(26)16-9-11(7-12-5-6-27-20(12)16)8-14-2-4-18(25)24-23-14/h1-7,9-10H,8H2,(H,24,25)