1-[2-(diphenylmethyl)pyridin-1-ium-1-yl]propan-2-one iodide

Systemtic Name: 1-[2-(diphenylmethyl)pyridin-1-ium-1-yl]propan-2-one iodide Openeye Name: 1-(2-benzhydrylpyridin-1-ium-1-yl)propan-2-one iodide CAS Name: 1-[2-(diphenylmethyl)-1-pyridin-1-iumyl]-2-propanone iodide IUPAC Name: 1-(2-benzhydrylpyridin-1-ium-1-yl)propan-2-one iodide Traditional Name: 1-(2-benzhydrylpyridin-1-ium-1-yl)acetone iodide Formula: C21H20INO MolecularWeight: 429.29407

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C[N+]1=CC=CC=C1C(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

Isomeric SMILES

CC(=O)C[N+]1=CC=CC=C1C(C2=CC=CC=C2)C3=CC=CC=C3.[I-]

InChI

InChI=1S/C21H20NO.HI/c1-17(23)16-22-15-9-8-14-20(22)21(18-10-4-2-5-11-18)19-12-6-3-7-13-19;/h2-15,21H,16H2,1H3;1H/q+1;/p-1