bis(4-fluorophenyl)-[1-(phenylmethyl)pyridin-1-ium-4-yl]methanol bromide

Systemtic Name: bis(4-fluorophenyl)-[1-(phenylmethyl)pyridin-1-ium-4-yl]methanol bromide Openeye Name: (1-benzylpyridin-1-ium-4-yl)-bis(4-fluorophenyl)methanol bromide CAS Name: bis(4-fluorophenyl)-[1-(phenylmethyl)-4-pyridin-1-iumyl]methanol bromide IUPAC Name: (1-benzylpyridin-1-ium-4-yl)-bis(4-fluorophenyl)methanol bromide Traditional Name: (1-benzylpyridin-1-ium-4-yl)-bis(4-fluorophenyl)methanol bromide Formula: C25H20BrF2NO MolecularWeight: 468.333206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H20F2NO.BrH/c26-23-10-6-20(7-11-23)25(29,21-8-12-24(27)13-9-21)22-14-16-28(17-15-22)18-19-4-2-1-3-5-19;/h1-17,29H,18H2;1H/q+1;/p-1