5-[[3,5-bis(iodanyl)-2-oxidanyl-phenyl]carbonylamino]-3-methyl-thiophene-2-carboxylic acid

Systemtic Name: 5-[[3,5-bis(iodanyl)-2-oxidanyl-phenyl]carbonylamino]-3-methyl-thiophene-2-carboxylic acid Openeye Name: 5-[(2-hydroxy-3,5-diiodo-benzoyl)amino]-3-methyl-thiophene-2-carboxylic acid CAS Name: 5-[[(2-hydroxy-3,5-diiodophenyl)-oxomethyl]amino]-3-methyl-2-thiophenecarboxylic acid IUPAC Name: 5-[(2-hydroxy-3,5-diiodobenzoyl)amino]-3-methylthiophene-2-carboxylic acid Traditional Name: 5-[(2-hydroxy-3,5-diiodo-benzoyl)amino]-3-methyl-2-thenoic acid Formula: C13H9I2NO4S MolecularWeight: 529.0888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)C2=CC(=CC(=C2O)I)I)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)C2=CC(=CC(=C2O)I)I)C(=O)O

InChI

InChI=1S/C13H9I2NO4S/c1-5-2-9(21-11(5)13(19)20)16-12(18)7-3-6(14)4-8(15)10(7)17/h2-4,17H,1H3,(H,16,18)(H,19,20)