2-[4-[(2R)-1,3-bis(phenylmethyl)imidazolidin-1-ium-2-yl]phenoxy]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-[(2R)-1,3-bis(phenylmethyl)imidazolidin-1-ium-2-yl]phenoxy]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-[(2R)-1,3-dibenzylimidazolidin-1-ium-2-yl]phenoxy]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[(2R)-1,3-bis(phenylmethyl)-2-imidazolidin-1-iumyl]phenoxy]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-[(2R)-1,3-dibenzylimidazolidin-1-ium-2-yl]phenoxy]-1-piperidin-1-ylethanone Traditional Name: 2-[4-[(2R)-1,3-dibenzylimidazolidin-1-ium-2-yl]phenoxy]-1-piperidino-ethanone Formula: C30H36N3O2+ MolecularWeight: 470.62574

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)COC2=CC=C(C=C2)C3[NH+](CCN3CC4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C(=O)COC2=CC=C(C=C2)[C@H]3[NH+](CCN3CC4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C30H35N3O2/c34-29(31-18-8-3-9-19-31)24-35-28-16-14-27(15-17-28)30-32(22-25-10-4-1-5-11-25)20-21-33(30)23-26-12-6-2-7-13-26/h1-2,4-7,10-17,30H,3,8-9,18-24H2/p+1