1-(4-phenylphenoxy)-3-(4-phenylpyridin-1-ium-1-yl)propan-2-ol chloride

Systemtic Name: 1-(4-phenylphenoxy)-3-(4-phenylpyridin-1-ium-1-yl)propan-2-ol chloride Openeye Name: 1-(4-phenylphenoxy)-3-(4-phenylpyridin-1-ium-1-yl)propan-2-ol chloride CAS Name: 1-(4-phenylphenoxy)-3-(4-phenyl-1-pyridin-1-iumyl)-2-propanol chloride IUPAC Name: 1-(4-phenylphenoxy)-3-(4-phenylpyridin-1-ium-1-yl)propan-2-ol chloride Traditional Name: 1-(4-phenylphenoxy)-3-(4-phenylpyridin-1-ium-1-yl)propan-2-ol chloride Formula: C26H24ClNO2 MolecularWeight: 417.92726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)OCC(C[N+]3=CC=C(C=C3)C4=CC=CC=C4)O.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)OCC(C[N+]3=CC=C(C=C3)C4=CC=CC=C4)O.[Cl-]

InChI

InChI=1S/C26H24NO2.ClH/c28-25(19-27-17-15-24(16-18-27)22-9-5-2-6-10-22)20-29-26-13-11-23(12-14-26)21-7-3-1-4-8-21;/h1-18,25,28H,19-20H2;1H/q+1;/p-1