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

Systemtic Name: 1-(4-phenylazanylphenoxy)-3-(4-phenylpyridin-1-ium-1-yl)propan-2-ol chloride Openeye Name: 1-(4-anilinophenoxy)-3-(4-phenylpyridin-1-ium-1-yl)propan-2-ol chloride CAS Name: 1-(4-anilinophenoxy)-3-(4-phenyl-1-pyridin-1-iumyl)-2-propanol chloride IUPAC Name: 1-(4-anilinophenoxy)-3-(4-phenylpyridin-1-ium-1-yl)propan-2-ol chloride Traditional Name: 1-(4-anilinophenoxy)-3-(4-phenylpyridin-1-ium-1-yl)propan-2-ol chloride Formula: C26H25ClN2O2 MolecularWeight: 432.9419

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=[N+](C=C2)CC(COC3=CC=C(C=C3)NC4=CC=CC=C4)O.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=[N+](C=C2)CC(COC3=CC=C(C=C3)NC4=CC=CC=C4)O.[Cl-]

InChI

InChI=1S/C26H25N2O2.ClH/c29-25(19-28-17-15-22(16-18-28)21-7-3-1-4-8-21)20-30-26-13-11-24(12-14-26)27-23-9-5-2-6-10-23;/h1-18,25,27,29H,19-20H2;1H/q+1;/p-1