2-[2-(3-methyl-1,2-oxazol-5-yl)-6-nitro-benzimidazol-1-yl]oxyethanoic acid

Systemtic Name: 2-[2-(3-methyl-1,2-oxazol-5-yl)-6-nitro-benzimidazol-1-yl]oxyethanoic acid Openeye Name: 2-[2-(3-methylisoxazol-5-yl)-6-nitro-benzimidazol-1-yl]oxyacetic acid CAS Name: 2-[[2-(3-methyl-5-isoxazolyl)-6-nitro-1-benzimidazolyl]oxy]acetic acid IUPAC Name: 2-[2-(3-methyl-1,2-oxazol-5-yl)-6-nitrobenzimidazol-1-yl]oxyacetic acid Traditional Name: 2-[2-(3-methylisoxazol-5-yl)-6-nitro-benzimidazol-1-yl]oxyacetic acid Formula: C13H10N4O6 MolecularWeight: 318.2417

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C2=NC3=C(N2OCC(=O)O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NOC(=C1)C2=NC3=C(N2OCC(=O)O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H10N4O6/c1-7-4-11(23-15-7)13-14-9-3-2-8(17(20)21)5-10(9)16(13)22-6-12(18)19/h2-5H,6H2,1H3,(H,18,19)