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sodium 3-acetamido-2,4-bis(iodanyl)-6-methyl-5-(methylcarbamoyl)benzoate

sodium 3-acetamido-2,4-bis(iodanyl)-6-methyl-5-(methylcarbamoyl)benzoate

Systemtic Name:sodium 3-acetamido-2,4-bis(iodanyl)-6-methyl-5-(methylcarbamoyl)benzoate
Openeye Name:sodium 3-acetamido-2,4-diiodo-6-methyl-5-(methylcarbamoyl)benzoate
CAS Name:sodium 3-acetamido-2,4-diiodo-6-methyl-5-(methylcarbamoyl)benzoate
IUPAC Name:sodium 3-acetamido-2,4-diiodo-6-methyl-5-(methylcarbamoyl)benzoate
Traditional Name:sodium 3-acetamido-2,4-diiodo-6-methyl-5-(methylcarbamoyl)benzoate
Formula: C12H11I2N2NaO4
MolecularWeight: 524.02545
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C(=O)[O-])I)NC(=O)C)I)C(=O)NC.[Na+]


Isomeric SMILES

CC1=C(C(=C(C(=C1C(=O)[O-])I)NC(=O)C)I)C(=O)NC.[Na+]


InChI

InChI=1S/C12H12I2N2O4.Na/c1-4-6(11(18)15-3)8(13)10(16-5(2)17)9(14)7(4)12(19)20;/h1-3H3,(H,15,18)(H,16,17)(H,19,20);/q;+1/p-1


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