1-[(3R)-1-methyl-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-4,4-diphenyl-imidazolidin-2-one iodide

Systemtic Name: 1-[(3R)-1-methyl-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-4,4-diphenyl-imidazolidin-2-one iodide Openeye Name: 1-[(3R)-1-benzyl-1-methyl-pyrrolidin-1-ium-3-yl]-4,4-diphenyl-imidazolidin-2-one iodide CAS Name: 1-[(3R)-1-methyl-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-4,4-diphenyl-2-imidazolidinone iodide IUPAC Name: 1-[(3R)-1-benzyl-1-methylpyrrolidin-1-ium-3-yl]-4,4-diphenylimidazolidin-2-one iodide Traditional Name: 1-[(3R)-1-benzyl-1-methyl-pyrrolidin-1-ium-3-yl]-4,4-diphenyl-2-imidazolidinone iodide Formula: C27H30IN3O MolecularWeight: 539.45107

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(C1)N2CC(NC2=O)(C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC=CC=C5.[I-]

Isomeric SMILES

C[N+]1(CC[C@H](C1)N2CC(NC2=O)(C3=CC=CC=C3)C4=CC=CC=C4)CC5=CC=CC=C5.[I-]

InChI

InChI=1S/C27H29N3O.HI/c1-30(19-22-11-5-2-6-12-22)18-17-25(20-30)29-21-27(28-26(29)31,23-13-7-3-8-14-23)24-15-9-4-10-16-24;/h2-16,25H,17-21H2,1H3;1H/t25-,30?;/m1./s1