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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)C2=CC(=CC(=C2O)I)I

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)C2=CC(=CC(=C2O)I)I

InChI

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