(2S)-2-(3-methoxy-4-phenylmethoxy-phenyl)-1,3-bis(phenylmethyl)imidazolidin-1-ium

Systemtic Name: (2S)-2-(3-methoxy-4-phenylmethoxy-phenyl)-1,3-bis(phenylmethyl)imidazolidin-1-ium Openeye Name: (2S)-1,3-dibenzyl-2-(4-benzyloxy-3-methoxy-phenyl)imidazolidin-1-ium CAS Name: (2S)-2-(3-methoxy-4-phenylmethoxyphenyl)-1,3-bis(phenylmethyl)imidazolidin-1-ium IUPAC Name: (2S)-1,3-dibenzyl-2-(3-methoxy-4-phenylmethoxyphenyl)imidazolidin-1-ium Traditional Name: (2S)-2-(4-benzoxy-3-methoxy-phenyl)-1,3-dibenzyl-imidazolidin-1-ium Formula: C31H33N2O2+ MolecularWeight: 465.60592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2[NH+](CCN2CC3=CC=CC=C3)CC4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)[C@@H]2[NH+](CCN2CC3=CC=CC=C3)CC4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C31H32N2O2/c1-34-30-21-28(17-18-29(30)35-24-27-15-9-4-10-16-27)31-32(22-25-11-5-2-6-12-25)19-20-33(31)23-26-13-7-3-8-14-26/h2-18,21,31H,19-20,22-24H2,1H3/p+1