4-(5-nitro-2-oxidanylidene-3H-benzimidazol-1-yl)butanoic acid

Systemtic Name: 4-(5-nitro-2-oxidanylidene-3H-benzimidazol-1-yl)butanoic acid Openeye Name: 4-(5-nitro-2-oxo-3H-benzimidazol-1-yl)butanoic acid CAS Name: 4-(5-nitro-2-oxo-3H-benzimidazol-1-yl)butanoic acid IUPAC Name: 4-(5-nitro-2-oxo-3H-benzimidazol-1-yl)butanoic acid Traditional Name: 4-(2-keto-5-nitro-3H-benzimidazol-1-yl)butyric acid Formula: C11H11N3O5 MolecularWeight: 265.22214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])NC(=O)N2CCCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])NC(=O)N2CCCC(=O)O

InChI

InChI=1S/C11H11N3O5/c15-10(16)2-1-5-13-9-4-3-7(14(18)19)6-8(9)12-11(13)17/h3-4,6H,1-2,5H2,(H,12,17)(H,15,16)