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

Systemtic Name: 2-[2-[(2S)-1,3-bis(phenylmethyl)imidazolidin-1-ium-2-yl]phenoxy]-1-morpholin-4-yl-ethanone Openeye Name: 2-[2-[(2S)-1,3-dibenzylimidazolidin-1-ium-2-yl]phenoxy]-1-morpholino-ethanone CAS Name: 2-[2-[(2S)-1,3-bis(phenylmethyl)-2-imidazolidin-1-iumyl]phenoxy]-1-(4-morpholinyl)ethanone IUPAC Name: 2-[2-[(2S)-1,3-dibenzylimidazolidin-1-ium-2-yl]phenoxy]-1-morpholin-4-ylethanone Traditional Name: 2-[2-[(2S)-1,3-dibenzylimidazolidin-1-ium-2-yl]phenoxy]-1-morpholino-ethanone Formula: C29H34N3O3+ MolecularWeight: 472.59856

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C([NH+]1CC2=CC=CC=C2)C3=CC=CC=C3OCC(=O)N4CCOCC4)CC5=CC=CC=C5

Isomeric SMILES

C1CN([C@@H]([NH+]1CC2=CC=CC=C2)C3=CC=CC=C3OCC(=O)N4CCOCC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H33N3O3/c33-28(30-17-19-34-20-18-30)23-35-27-14-8-7-13-26(27)29-31(21-24-9-3-1-4-10-24)15-16-32(29)22-25-11-5-2-6-12-25/h1-14,29H,15-23H2/p+1