2-(2-ethyl-5-nitro-benzimidazol-2-yl)ethanoic acid

Systemtic Name: 2-(2-ethyl-5-nitro-benzimidazol-2-yl)ethanoic acid Openeye Name: 2-(2-ethyl-5-nitro-benzimidazol-2-yl)acetic acid CAS Name: 2-(2-ethyl-5-nitro-2-benzimidazolyl)acetic acid IUPAC Name: 2-(2-ethyl-5-nitrobenzimidazol-2-yl)acetic acid Traditional Name: 2-(2-ethyl-5-nitro-benzimidazol-2-yl)acetic acid Formula: C11H11N3O4 MolecularWeight: 249.22274

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(N=C2C=CC(=CC2=N1)[N+](=O)[O-])CC(=O)O

Isomeric SMILES

CCC1(N=C2C=CC(=CC2=N1)[N+](=O)[O-])CC(=O)O

InChI

InChI=1S/C11H11N3O4/c1-2-11(6-10(15)16)12-8-4-3-7(14(17)18)5-9(8)13-11/h3-5H,2,6H2,1H3,(H,15,16)