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

Systemtic Name: 3-[(2S)-1,3-bis[(2-hydroxyphenyl)methyl]imidazolidin-1-ium-2-yl]-4-bromanyl-phenol Openeye Name: 3-[(2S)-1,3-bis[(2-hydroxyphenyl)methyl]imidazolidin-1-ium-2-yl]-4-bromo-phenol CAS Name: 3-[(2S)-1,3-bis[(2-hydroxyphenyl)methyl]-2-imidazolidin-1-iumyl]-4-bromophenol IUPAC Name: 3-[(2S)-1,3-bis[(2-hydroxyphenyl)methyl]imidazolidin-1-ium-2-yl]-4-bromophenol Traditional Name: 4-bromo-3-[(2S)-1,3-disalicylimidazolidin-1-ium-2-yl]phenol Formula: C23H24BrN2O3+ MolecularWeight: 456.35226

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C([NH+]1CC2=CC=CC=C2O)C3=C(C=CC(=C3)O)Br)CC4=CC=CC=C4O

Isomeric SMILES

C1CN([C@@H]([NH+]1CC2=CC=CC=C2O)C3=C(C=CC(=C3)O)Br)CC4=CC=CC=C4O

InChI

InChI=1S/C23H23BrN2O3/c24-20-10-9-18(27)13-19(20)23-25(14-16-5-1-3-7-21(16)28)11-12-26(23)15-17-6-2-4-8-22(17)29/h1-10,13,23,27-29H,11-12,14-15H2/p+1