tert-butyl 7-fluoranyl-4-methyl-5-nitro-benzimidazole-1-carboxylate

Systemtic Name: tert-butyl 7-fluoranyl-4-methyl-5-nitro-benzimidazole-1-carboxylate Openeye Name: tert-butyl 7-fluoro-4-methyl-5-nitro-benzimidazole-1-carboxylate CAS Name: 7-fluoro-4-methyl-5-nitro-1-benzimidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-fluoro-4-methyl-5-nitrobenzimidazole-1-carboxylate Traditional Name: 7-fluoro-4-methyl-5-nitro-benzimidazole-1-carboxylic acid tert-butyl ester Formula: C13H14FN3O4 MolecularWeight: 295.266363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1[N+](=O)[O-])F)N(C=N2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C2C(=C(C=C1[N+](=O)[O-])F)N(C=N2)C(=O)OC(C)(C)C

InChI

InChI=1S/C13H14FN3O4/c1-7-9(17(19)20)5-8(14)11-10(7)15-6-16(11)12(18)21-13(2,3)4/h5-6H,1-4H3