2-[2-(furan-3-yl)-6-nitro-benzimidazol-1-yl]oxyethanoic acid

Systemtic Name: 2-[2-(furan-3-yl)-6-nitro-benzimidazol-1-yl]oxyethanoic acid Openeye Name: 2-[2-(3-furyl)-6-nitro-benzimidazol-1-yl]oxyacetic acid CAS Name: 2-[[2-(3-furanyl)-6-nitro-1-benzimidazolyl]oxy]acetic acid IUPAC Name: 2-[2-(furan-3-yl)-6-nitrobenzimidazol-1-yl]oxyacetic acid Traditional Name: 2-[2-(3-furyl)-6-nitro-benzimidazol-1-yl]oxyacetic acid Formula: C13H9N3O6 MolecularWeight: 303.22706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])N(C(=N2)C3=COC=C3)OCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])N(C(=N2)C3=COC=C3)OCC(=O)O

InChI

InChI=1S/C13H9N3O6/c17-12(18)7-22-15-11-5-9(16(19)20)1-2-10(11)14-13(15)8-3-4-21-6-8/h1-6H,7H2,(H,17,18)