2-[[3-[(2-hydroxyphenyl)methyl]-2-(3-nitrophenyl)imidazolidine-1,3-diium-1-yl]methyl]phenol

Systemtic Name: 2-[[3-[(2-hydroxyphenyl)methyl]-2-(3-nitrophenyl)imidazolidine-1,3-diium-1-yl]methyl]phenol Openeye Name: 2-[[3-[(2-hydroxyphenyl)methyl]-2-(3-nitrophenyl)imidazolidine-1,3-diium-1-yl]methyl]phenol CAS Name: 2-[[3-[(2-hydroxyphenyl)methyl]-2-(3-nitrophenyl)-1-imidazolidine-1,3-diiumyl]methyl]phenol IUPAC Name: 2-[[3-[(2-hydroxyphenyl)methyl]-2-(3-nitrophenyl)imidazolidine-1,3-diium-1-yl]methyl]phenol Traditional Name: 2-[[2-(3-nitrophenyl)-3-salicyl-imidazolidine-1,3-diium-1-yl]methyl]phenol Formula: C23H25N3O4+2 MolecularWeight: 407.4623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C([NH+]1CC2=CC=CC=C2O)C3=CC(=CC=C3)[N+](=O)[O-])CC4=CC=CC=C4O

Isomeric SMILES

C1C[NH+](C([NH+]1CC2=CC=CC=C2O)C3=CC(=CC=C3)[N+](=O)[O-])CC4=CC=CC=C4O

InChI

InChI=1S/C23H23N3O4/c27-21-10-3-1-6-18(21)15-24-12-13-25(16-19-7-2-4-11-22(19)28)23(24)17-8-5-9-20(14-17)26(29)30/h1-11,14,23,27-28H,12-13,15-16H2/p+2