6-(1,3-benzodioxol-5-yl)-2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyridazin-3-one

Systemtic Name: 6-(1,3-benzodioxol-5-yl)-2-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyridazin-3-one Openeye Name: 6-(1,3-benzodioxol-5-yl)-2-[(2-chloro-6-fluoro-phenyl)methyl]pyridazin-3-one CAS Name: 6-(1,3-benzodioxol-5-yl)-2-[(2-chloro-6-fluorophenyl)methyl]-3-pyridazinone IUPAC Name: 6-(1,3-benzodioxol-5-yl)-2-[(2-chloro-6-fluorophenyl)methyl]pyridazin-3-one Traditional Name: 6-(1,3-benzodioxol-5-yl)-2-(2-chloro-6-fluoro-benzyl)pyridazin-3-one Formula: C18H12ClFN2O3 MolecularWeight: 358.750883

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=NN(C(=O)C=C3)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=NN(C(=O)C=C3)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C18H12ClFN2O3/c19-13-2-1-3-14(20)12(13)9-22-18(23)7-5-15(21-22)11-4-6-16-17(8-11)25-10-24-16/h1-8H,9-10H2