1-(4-chlorophenyl)-2-[4-(4-fluorophenyl)pyrimidin-1-ium-1-yl]ethanone

Systemtic Name: 1-(4-chlorophenyl)-2-[4-(4-fluorophenyl)pyrimidin-1-ium-1-yl]ethanone Openeye Name: 1-(4-chlorophenyl)-2-[4-(4-fluorophenyl)pyrimidin-1-ium-1-yl]ethanone CAS Name: 1-(4-chlorophenyl)-2-[4-(4-fluorophenyl)-1-pyrimidin-1-iumyl]ethanone IUPAC Name: 1-(4-chlorophenyl)-2-[4-(4-fluorophenyl)pyrimidin-1-ium-1-yl]ethanone Traditional Name: 1-(4-chlorophenyl)-2-[4-(4-fluorophenyl)pyrimidin-1-ium-1-yl]ethanone Formula: C18H13ClFN2O+ MolecularWeight: 327.760023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC=[N+](C=C2)CC(=O)C3=CC=C(C=C3)Cl)F

Isomeric SMILES

C1=CC(=CC=C1C2=NC=[N+](C=C2)CC(=O)C3=CC=C(C=C3)Cl)F

InChI

InChI=1S/C18H13ClFN2O/c19-15-5-1-14(2-6-15)18(23)11-22-10-9-17(21-12-22)13-3-7-16(20)8-4-13/h1-10,12H,11H2/q+1