1-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]-2,6-dimethyl-4-oxidanylidene-pyridine-3,5-dicarboxylic acid

Systemtic Name: 1-[3,5-bis(iodanyl)-4-oxidanyl-phenyl]-2,6-dimethyl-4-oxidanylidene-pyridine-3,5-dicarboxylic acid Openeye Name: 1-(4-hydroxy-3,5-diiodo-phenyl)-2,6-dimethyl-4-oxo-pyridine-3,5-dicarboxylic acid CAS Name: 1-(4-hydroxy-3,5-diiodophenyl)-2,6-dimethyl-4-oxopyridine-3,5-dicarboxylic acid IUPAC Name: 1-(4-hydroxy-3,5-diiodophenyl)-2,6-dimethyl-4-oxopyridine-3,5-dicarboxylic acid Traditional Name: 1-(4-hydroxy-3,5-diiodo-phenyl)-4-keto-2,6-dimethyl-dinicotinic acid Formula: C15H11I2NO6 MolecularWeight: 555.05988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=C(N1C2=CC(=C(C(=C2)I)O)I)C)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C(=O)C(=C(N1C2=CC(=C(C(=C2)I)O)I)C)C(=O)O)C(=O)O

InChI

InChI=1S/C15H11I2NO6/c1-5-10(14(21)22)13(20)11(15(23)24)6(2)18(5)7-3-8(16)12(19)9(17)4-7/h3-4,19H,1-2H3,(H,21,22)(H,23,24)