ethyl 4-nitro-2,6-bis(trifluoromethyl)benzimidazole-2-carboxylate

Systemtic Name: ethyl 4-nitro-2,6-bis(trifluoromethyl)benzimidazole-2-carboxylate Openeye Name: ethyl 4-nitro-2,6-bis(trifluoromethyl)benzimidazole-2-carboxylate CAS Name: 4-nitro-2,6-bis(trifluoromethyl)-2-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-nitro-2,6-bis(trifluoromethyl)benzimidazole-2-carboxylate Traditional Name: 4-nitro-2,6-bis(trifluoromethyl)benzimidazole-2-carboxylic acid ethyl ester Formula: C12H7F6N3O4 MolecularWeight: 371.192099

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(N=C2C=C(C=C(C2=N1)[N+](=O)[O-])C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1(N=C2C=C(C=C(C2=N1)[N+](=O)[O-])C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C12H7F6N3O4/c1-2-25-9(22)10(12(16,17)18)19-6-3-5(11(13,14)15)4-7(21(23)24)8(6)20-10/h3-4H,2H2,1H3