3-(dimethylsulfamoyl)-5-fluoranyl-4-[(4-iodanyl-2-methyl-phenyl)amino]benzoic acid

Systemtic Name: 3-(dimethylsulfamoyl)-5-fluoranyl-4-[(4-iodanyl-2-methyl-phenyl)amino]benzoic acid Openeye Name: 3-(dimethylsulfamoyl)-5-fluoro-4-(4-iodo-2-methyl-anilino)benzoic acid CAS Name: 3-(dimethylsulfamoyl)-5-fluoro-4-(4-iodo-2-methylanilino)benzoic acid IUPAC Name: 3-(dimethylsulfamoyl)-5-fluoro-4-(4-iodo-2-methylanilino)benzoic acid Traditional Name: 3-(dimethylsulfamoyl)-5-fluoro-4-(4-iodo-2-methyl-anilino)benzoic acid Formula: C16H16FIN2O4S MolecularWeight: 478.277113

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=C(C=C(C=C2S(=O)(=O)N(C)C)C(=O)O)F

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C=C(C=C2S(=O)(=O)N(C)C)C(=O)O)F

InChI

InChI=1S/C16H16FIN2O4S/c1-9-6-11(18)4-5-13(9)19-15-12(17)7-10(16(21)22)8-14(15)25(23,24)20(2)3/h4-8,19H,1-3H3,(H,21,22)