N-[(1-methylpyridin-1-ium-4-yl)methyl]-2-oxidanyl-2,2-diphenyl-ethanamide iodide

Systemtic Name: N-[(1-methylpyridin-1-ium-4-yl)methyl]-2-oxidanyl-2,2-diphenyl-ethanamide iodide Openeye Name: 2-hydroxy-N-[(1-methylpyridin-1-ium-4-yl)methyl]-2,2-diphenyl-acetamide iodide CAS Name: 2-hydroxy-N-[(1-methyl-4-pyridin-1-iumyl)methyl]-2,2-diphenylacetamide iodide IUPAC Name: 2-hydroxy-N-[(1-methylpyridin-1-ium-4-yl)methyl]-2,2-diphenylacetamide iodide Traditional Name: 2-hydroxy-N-[(1-methylpyridin-1-ium-4-yl)methyl]-2,2-diphenyl-acetamide iodide Formula: C21H21IN2O2 MolecularWeight: 460.30811

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O2.HI/c1-23-14-12-17(13-15-23)16-22-20(24)21(25,18-8-4-2-5-9-18)19-10-6-3-7-11-19;/h2-15,25H,16H2,1H3;1H