2-[[3-[(2-hydroxyphenyl)methyl]-2-(5-nitrofuran-2-yl)imidazolidine-1,3-diium-1-yl]methyl]phenol

Systemtic Name: 2-[[3-[(2-hydroxyphenyl)methyl]-2-(5-nitrofuran-2-yl)imidazolidine-1,3-diium-1-yl]methyl]phenol Openeye Name: 2-[[3-[(2-hydroxyphenyl)methyl]-2-(5-nitro-2-furyl)imidazolidine-1,3-diium-1-yl]methyl]phenol CAS Name: 2-[[3-[(2-hydroxyphenyl)methyl]-2-(5-nitro-2-furanyl)-1-imidazolidine-1,3-diiumyl]methyl]phenol IUPAC Name: 2-[[3-[(2-hydroxyphenyl)methyl]-2-(5-nitrofuran-2-yl)imidazolidine-1,3-diium-1-yl]methyl]phenol Traditional Name: 2-[[2-(5-nitro-2-furyl)-3-salicyl-imidazolidine-1,3-diium-1-yl]methyl]phenol Formula: C21H23N3O5+2 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C([NH+]1CC2=CC=CC=C2O)C3=CC=C(O3)[N+](=O)[O-])CC4=CC=CC=C4O

Isomeric SMILES

C1C[NH+](C([NH+]1CC2=CC=CC=C2O)C3=CC=C(O3)[N+](=O)[O-])CC4=CC=CC=C4O

InChI

InChI=1S/C21H21N3O5/c25-17-7-3-1-5-15(17)13-22-11-12-23(14-16-6-2-4-8-18(16)26)21(22)19-9-10-20(29-19)24(27)28/h1-10,21,25-26H,11-14H2/p+2