3-[[3-(3-bromanyl-5-methyl-phenoxy)-4-chloranyl-phenyl]methyl]-5-methyl-1H-pyridazin-6-one

Systemtic Name: 3-[[3-(3-bromanyl-5-methyl-phenoxy)-4-chloranyl-phenyl]methyl]-5-methyl-1H-pyridazin-6-one Openeye Name: 3-[[3-(3-bromo-5-methyl-phenoxy)-4-chloro-phenyl]methyl]-5-methyl-1H-pyridazin-6-one CAS Name: 3-[[3-(3-bromo-5-methylphenoxy)-4-chlorophenyl]methyl]-5-methyl-1H-pyridazin-6-one IUPAC Name: 3-[[3-(3-bromo-5-methylphenoxy)-4-chlorophenyl]methyl]-5-methyl-1H-pyridazin-6-one Traditional Name: 3-[3-(3-bromo-5-methyl-phenoxy)-4-chloro-benzyl]-5-methyl-1H-pyridazin-6-one Formula: C19H16BrClN2O2 MolecularWeight: 419.69954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16BrClN2O2/c1-11-5-14(20)10-16(6-11)25-18-9-13(3-4-17(18)21)8-15-7-12(2)19(24)23-22-15/h3-7,9-10H,8H2,1-2H3,(H,23,24)