4-[(4-iodophenyl)sulfamoyl]-2,5-dimethyl-furan-3-carboxylic acid

Systemtic Name: 4-[(4-iodophenyl)sulfamoyl]-2,5-dimethyl-furan-3-carboxylic acid Openeye Name: 4-[(4-iodophenyl)sulfamoyl]-2,5-dimethyl-furan-3-carboxylic acid CAS Name: 4-[(4-iodophenyl)sulfamoyl]-2,5-dimethyl-3-furancarboxylic acid IUPAC Name: 4-[(4-iodophenyl)sulfamoyl]-2,5-dimethylfuran-3-carboxylic acid Traditional Name: 4-[(4-iodophenyl)sulfamoyl]-2,5-dimethyl-3-furoic acid Formula: C13H12INO5S MolecularWeight: 421.20755

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)C)S(=O)(=O)NC2=CC=C(C=C2)I)C(=O)O

Isomeric SMILES

CC1=C(C(=C(O1)C)S(=O)(=O)NC2=CC=C(C=C2)I)C(=O)O

InChI

InChI=1S/C13H12INO5S/c1-7-11(13(16)17)12(8(2)20-7)21(18,19)15-10-5-3-9(14)4-6-10/h3-6,15H,1-2H3,(H,16,17)