1-[1-methyl-1-(phenylmethyl)piperidin-1-ium-4-yl]-4,4-diphenyl-imidazolidin-2-one iodide

Systemtic Name: 1-[1-methyl-1-(phenylmethyl)piperidin-1-ium-4-yl]-4,4-diphenyl-imidazolidin-2-one iodide Openeye Name: 1-(1-benzyl-1-methyl-piperidin-1-ium-4-yl)-4,4-diphenyl-imidazolidin-2-one iodide CAS Name: 1-[1-methyl-1-(phenylmethyl)-4-piperidin-1-iumyl]-4,4-diphenyl-2-imidazolidinone iodide IUPAC Name: 1-(1-benzyl-1-methylpiperidin-1-ium-4-yl)-4,4-diphenylimidazolidin-2-one iodide Traditional Name: 1-(1-benzyl-1-methyl-piperidin-1-ium-4-yl)-4,4-diphenyl-2-imidazolidinone iodide Formula: C28H32IN3O MolecularWeight: 553.47765

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)N2CC(NC2=O)(C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC=CC=C5.[I-]

Isomeric SMILES

C[N+]1(CCC(CC1)N2CC(NC2=O)(C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC=CC=C5.[I-]

InChI

InChI=1S/C28H31N3O.HI/c1-31(21-23-11-5-2-6-12-23)19-17-26(18-20-31)30-22-28(29-27(30)32,24-13-7-3-8-14-24)25-15-9-4-10-16-25;/h2-16,26H,17-22H2,1H3;1H