2-[[(2S)-2-(4-ethoxyphenyl)-3-[(2-hydroxyphenyl)methyl]imidazolidin-1-ium-1-yl]methyl]phenol

Systemtic Name: 2-[[(2S)-2-(4-ethoxyphenyl)-3-[(2-hydroxyphenyl)methyl]imidazolidin-1-ium-1-yl]methyl]phenol Openeye Name: 2-[[(2S)-2-(4-ethoxyphenyl)-3-[(2-hydroxyphenyl)methyl]imidazolidin-1-ium-1-yl]methyl]phenol CAS Name: 2-[[(2S)-2-(4-ethoxyphenyl)-3-[(2-hydroxyphenyl)methyl]-1-imidazolidin-1-iumyl]methyl]phenol IUPAC Name: 2-[[(2S)-2-(4-ethoxyphenyl)-3-[(2-hydroxyphenyl)methyl]imidazolidin-1-ium-1-yl]methyl]phenol Traditional Name: 2-[[(2S)-2-p-phenetyl-3-salicyl-imidazolidin-1-ium-1-yl]methyl]phenol Formula: C25H29N2O3+ MolecularWeight: 405.50936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2[NH+](CCN2CC3=CC=CC=C3O)CC4=CC=CC=C4O

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@@H]2[NH+](CCN2CC3=CC=CC=C3O)CC4=CC=CC=C4O

InChI

InChI=1S/C25H28N2O3/c1-2-30-22-13-11-19(12-14-22)25-26(17-20-7-3-5-9-23(20)28)15-16-27(25)18-21-8-4-6-10-24(21)29/h3-14,25,28-29H,2,15-18H2,1H3/p+1