2-[1,3-bis(phenylmethyl)imidazolidine-1,3-diium-2-yl]-4-bromanyl-phenol

Systemtic Name: 2-[1,3-bis(phenylmethyl)imidazolidine-1,3-diium-2-yl]-4-bromanyl-phenol Openeye Name: 4-bromo-2-(1,3-dibenzylimidazolidine-1,3-diium-2-yl)phenol CAS Name: 2-[1,3-bis(phenylmethyl)-2-imidazolidine-1,3-diiumyl]-4-bromophenol IUPAC Name: 4-bromo-2-(1,3-dibenzylimidazolidine-1,3-diium-2-yl)phenol Traditional Name: 4-bromo-2-(1,3-dibenzylimidazolidine-1,3-diium-2-yl)phenol Formula: C23H25BrN2O+2 MolecularWeight: 425.3614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C([NH+]1CC2=CC=CC=C2)C3=C(C=CC(=C3)Br)O)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](C([NH+]1CC2=CC=CC=C2)C3=C(C=CC(=C3)Br)O)CC4=CC=CC=C4

InChI

InChI=1S/C23H23BrN2O/c24-20-11-12-22(27)21(15-20)23-25(16-18-7-3-1-4-8-18)13-14-26(23)17-19-9-5-2-6-10-19/h1-12,15,23,27H,13-14,16-17H2/p+2