2-[4-(3-chlorophenyl)pyrimidin-1-ium-1-yl]-1-(4-fluorophenyl)ethanone

Systemtic Name: 2-[4-(3-chlorophenyl)pyrimidin-1-ium-1-yl]-1-(4-fluorophenyl)ethanone Openeye Name: 2-[4-(3-chlorophenyl)pyrimidin-1-ium-1-yl]-1-(4-fluorophenyl)ethanone CAS Name: 2-[4-(3-chlorophenyl)-1-pyrimidin-1-iumyl]-1-(4-fluorophenyl)ethanone IUPAC Name: 2-[4-(3-chlorophenyl)pyrimidin-1-ium-1-yl]-1-(4-fluorophenyl)ethanone Traditional Name: 2-[4-(3-chlorophenyl)pyrimidin-1-ium-1-yl]-1-(4-fluorophenyl)ethanone Formula: C18H13ClFN2O+ MolecularWeight: 327.760023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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