ethyl 6-nitro-1-[2,2,2-tris(chloranyl)ethoxycarbonyloxy]benzimidazole-2-carboxylate

Systemtic Name: ethyl 6-nitro-1-[2,2,2-tris(chloranyl)ethoxycarbonyloxy]benzimidazole-2-carboxylate Openeye Name: ethyl 6-nitro-1-(2,2,2-trichloroethoxycarbonyloxy)benzimidazole-2-carboxylate CAS Name: 6-nitro-1-[oxo(2,2,2-trichloroethoxy)methoxy]-2-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 6-nitro-1-(2,2,2-trichloroethoxycarbonyloxy)benzimidazole-2-carboxylate Traditional Name: 6-nitro-1-(2,2,2-trichloroethoxycarbonyloxy)benzimidazole-2-carboxylic acid ethyl ester Formula: C13H10Cl3N3O7 MolecularWeight: 426.5934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=C(N1OC(=O)OCC(Cl)(Cl)Cl)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NC2=C(N1OC(=O)OCC(Cl)(Cl)Cl)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H10Cl3N3O7/c1-2-24-11(20)10-17-8-4-3-7(19(22)23)5-9(8)18(10)26-12(21)25-6-13(14,15)16/h3-5H,2,6H2,1H3