diphenylphosphoryl-(1-ethylpyridin-1-ium-3-yl)methanol iodide

Systemtic Name: diphenylphosphoryl-(1-ethylpyridin-1-ium-3-yl)methanol iodide Openeye Name: diphenylphosphoryl-(1-ethylpyridin-1-ium-3-yl)methanol iodide CAS Name: diphenylphosphoryl-(1-ethyl-3-pyridin-1-iumyl)methanol iodide IUPAC Name: diphenylphosphoryl-(1-ethylpyridin-1-ium-3-yl)methanol iodide Traditional Name: diphenylphosphoryl-(1-ethylpyridin-1-ium-3-yl)methanol iodide Formula: C20H21INO2P MolecularWeight: 465.264471

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=CC(=C1)C(O)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

Isomeric SMILES

CC[N+]1=CC=CC(=C1)C(O)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C20H21NO2P.HI/c1-2-21-15-9-10-17(16-21)20(22)24(23,18-11-5-3-6-12-18)19-13-7-4-8-14-19;/h3-16,20,22H,2H2,1H3;1H/q+1;/p-1