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

Systemtic Name: 3-[[3-(3-bromanylphenoxy)-4-chloranyl-phenyl]methyl]-5-(hydroxymethyl)-1H-pyridazin-6-one Openeye Name: 3-[[3-(3-bromophenoxy)-4-chloro-phenyl]methyl]-5-(hydroxymethyl)-1H-pyridazin-6-one CAS Name: 3-[[3-(3-bromophenoxy)-4-chlorophenyl]methyl]-5-(hydroxymethyl)-1H-pyridazin-6-one IUPAC Name: 3-[[3-(3-bromophenoxy)-4-chlorophenyl]methyl]-5-(hydroxymethyl)-1H-pyridazin-6-one Traditional Name: 3-[3-(3-bromophenoxy)-4-chloro-benzyl]-5-methylol-1H-pyridazin-6-one Formula: C18H14BrClN2O3 MolecularWeight: 421.67236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14BrClN2O3/c19-13-2-1-3-15(9-13)25-17-7-11(4-5-16(17)20)6-14-8-12(10-23)18(24)22-21-14/h1-5,7-9,23H,6,10H2,(H,22,24)