5,6-bis(4-methoxyphenyl)-2-[[2,4,6-tris(chloranyl)phenyl]methyl]pyridazin-3-one

Systemtic Name: 5,6-bis(4-methoxyphenyl)-2-[[2,4,6-tris(chloranyl)phenyl]methyl]pyridazin-3-one Openeye Name: 5,6-bis(4-methoxyphenyl)-2-[(2,4,6-trichlorophenyl)methyl]pyridazin-3-one CAS Name: 5,6-bis(4-methoxyphenyl)-2-[(2,4,6-trichlorophenyl)methyl]-3-pyridazinone IUPAC Name: 5,6-bis(4-methoxyphenyl)-2-[(2,4,6-trichlorophenyl)methyl]pyridazin-3-one Traditional Name: 5,6-bis(4-methoxyphenyl)-2-(2,4,6-trichlorobenzyl)pyridazin-3-one Formula: C25H19Cl3N2O3 MolecularWeight: 501.78896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=O)N(N=C2C3=CC=C(C=C3)OC)CC4=C(C=C(C=C4Cl)Cl)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=O)N(N=C2C3=CC=C(C=C3)OC)CC4=C(C=C(C=C4Cl)Cl)Cl

InChI

InChI=1S/C25H19Cl3N2O3/c1-32-18-7-3-15(4-8-18)20-13-24(31)30(14-21-22(27)11-17(26)12-23(21)28)29-25(20)16-5-9-19(33-2)10-6-16/h3-13H,14H2,1-2H3