4-(6-fluoranyl-3-phenyl-1-benzofuran-2-yl)-1-(phenylmethyl)pyridin-1-ium bromide

Systemtic Name: 4-(6-fluoranyl-3-phenyl-1-benzofuran-2-yl)-1-(phenylmethyl)pyridin-1-ium bromide Openeye Name: 1-benzyl-4-(6-fluoro-3-phenyl-benzofuran-2-yl)pyridin-1-ium bromide CAS Name: 4-(6-fluoro-3-phenyl-2-benzofuranyl)-1-(phenylmethyl)pyridin-1-ium bromide IUPAC Name: 1-benzyl-4-(6-fluoro-3-phenyl-1-benzofuran-2-yl)pyridin-1-ium bromide Traditional Name: 1-benzyl-4-(6-fluoro-3-phenyl-benzofuran-2-yl)pyridin-1-ium bromide Formula: C26H19BrFNO MolecularWeight: 460.337563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=CC=C(C=C2)C3=C(C4=C(O3)C=C(C=C4)F)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=CC=C(C=C2)C3=C(C4=C(O3)C=C(C=C4)F)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C26H19FNO.BrH/c27-22-11-12-23-24(17-22)29-26(25(23)20-9-5-2-6-10-20)21-13-15-28(16-14-21)18-19-7-3-1-4-8-19;/h1-17H,18H2;1H/q+1;/p-1