butyl 4-fluoranyl-7-methyl-6-nitro-1H-benzimidazole-2-carboxylate

Systemtic Name: butyl 4-fluoranyl-7-methyl-6-nitro-1H-benzimidazole-2-carboxylate Openeye Name: butyl 4-fluoro-7-methyl-6-nitro-1H-benzimidazole-2-carboxylate CAS Name: 4-fluoro-7-methyl-6-nitro-1H-benzimidazole-2-carboxylic acid butyl ester IUPAC Name: butyl 4-fluoro-7-methyl-6-nitro-1H-benzimidazole-2-carboxylate Traditional Name: 4-fluoro-7-methyl-6-nitro-1H-benzimidazole-2-carboxylic acid butyl ester Formula: C13H14FN3O4 MolecularWeight: 295.266363

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=NC2=C(C=C(C(=C2N1)C)[N+](=O)[O-])F

Isomeric SMILES

CCCCOC(=O)C1=NC2=C(C=C(C(=C2N1)C)[N+](=O)[O-])F

InChI

InChI=1S/C13H14FN3O4/c1-3-4-5-21-13(18)12-15-10-7(2)9(17(19)20)6-8(14)11(10)16-12/h6H,3-5H2,1-2H3,(H,15,16)