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

Systemtic Name: 7-fluoranyl-6-[(4-iodanyl-2-methyl-phenyl)amino]benzimidazole-1,5-dicarboxylic acid Openeye Name: 7-fluoro-6-(4-iodo-2-methyl-anilino)benzimidazole-1,5-dicarboxylic acid CAS Name: 7-fluoro-6-(4-iodo-2-methylanilino)benzimidazole-1,5-dicarboxylic acid IUPAC Name: 7-fluoro-6-(4-iodo-2-methylanilino)benzimidazole-1,5-dicarboxylic acid Traditional Name: 7-fluoro-6-(4-iodo-2-methyl-anilino)benzimidazole-1,5-dicarboxylic acid Formula: C16H11FIN3O4 MolecularWeight: 455.179113

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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)O)F

Isomeric SMILES

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

InChI

InChI=1S/C16H11FIN3O4/c1-7-4-8(18)2-3-10(7)20-13-9(15(22)23)5-11-14(12(13)17)21(6-19-11)16(24)25/h2-6,20H,1H3,(H,22,23)(H,24,25)