1-ethanoyl-7-fluoranyl-6-[(4-iodanyl-2-methyl-phenyl)amino]benzimidazole-5-carboxylic acid

Systemtic Name: 1-ethanoyl-7-fluoranyl-6-[(4-iodanyl-2-methyl-phenyl)amino]benzimidazole-5-carboxylic acid Openeye Name: 1-acetyl-7-fluoro-6-(4-iodo-2-methyl-anilino)benzimidazole-5-carboxylic acid CAS Name: 1-acetyl-7-fluoro-6-(4-iodo-2-methylanilino)-5-benzimidazolecarboxylic acid IUPAC Name: 1-acetyl-7-fluoro-6-(4-iodo-2-methylanilino)benzimidazole-5-carboxylic acid Traditional Name: 1-acetyl-7-fluoro-6-(4-iodo-2-methyl-anilino)benzimidazole-5-carboxylic acid Formula: C17H13FIN3O3 MolecularWeight: 453.206293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=C(C3=C(C=C2C(=O)O)N=CN3C(=O)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C3=C(C=C2C(=O)O)N=CN3C(=O)C)F

InChI

InChI=1S/C17H13FIN3O3/c1-8-5-10(19)3-4-12(8)21-15-11(17(24)25)6-13-16(14(15)18)22(7-20-13)9(2)23/h3-7,21H,1-2H3,(H,24,25)