phenyl 6-[bis(fluoranyl)methyl]-4-nitro-2-[1,1,2,2,2-pentakis(fluoranyl)ethyl]benzimidazole-1-carboxylate

Systemtic Name: phenyl 6-[bis(fluoranyl)methyl]-4-nitro-2-[1,1,2,2,2-pentakis(fluoranyl)ethyl]benzimidazole-1-carboxylate Openeye Name: phenyl 6-(difluoromethyl)-4-nitro-2-(1,1,2,2,2-pentafluoroethyl)benzimidazole-1-carboxylate CAS Name: 6-(difluoromethyl)-4-nitro-2-(1,1,2,2,2-pentafluoroethyl)-1-benzimidazolecarboxylic acid phenyl ester IUPAC Name: phenyl 6-(difluoromethyl)-4-nitro-2-(1,1,2,2,2-pentafluoroethyl)benzimidazole-1-carboxylate Traditional Name: 6-(difluoromethyl)-4-nitro-2-(1,1,2,2,2-pentafluoroethyl)benzimidazole-1-carboxylic acid phenyl ester Formula: C17H8F7N3O4 MolecularWeight: 451.251942

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)N2C3=C(C(=CC(=C3)C(F)F)[N+](=O)[O-])N=C2C(C(F)(F)F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)N2C3=C(C(=CC(=C3)C(F)F)[N+](=O)[O-])N=C2C(C(F)(F)F)(F)F

InChI

InChI=1S/C17H8F7N3O4/c18-13(19)8-6-10-12(11(7-8)27(29)30)25-14(16(20,21)17(22,23)24)26(10)15(28)31-9-4-2-1-3-5-9/h1-7,13H