sodium 4-[(3-iodanyl-2-oxidanyl-propanoyl)amino]-3-methyl-benzoate

Systemtic Name: sodium 4-[(3-iodanyl-2-oxidanyl-propanoyl)amino]-3-methyl-benzoate Openeye Name: sodium 4-[(2-hydroxy-3-iodo-propanoyl)amino]-3-methyl-benzoate CAS Name: sodium 4-[(2-hydroxy-3-iodo-1-oxopropyl)amino]-3-methylbenzoate IUPAC Name: sodium 4-[(2-hydroxy-3-iodopropanoyl)amino]-3-methylbenzoate Traditional Name: sodium 4-[(2-hydroxy-3-iodo-propanoyl)amino]-3-methyl-benzoate Formula: C11H11INNaO4 MolecularWeight: 371.10358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)[O-])NC(=O)C(CI)O.[Na+]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)[O-])NC(=O)C(CI)O.[Na+]

InChI

InChI=1S/C11H12INO4.Na/c1-6-4-7(11(16)17)2-3-8(6)13-10(15)9(14)5-12;/h2-4,9,14H,5H2,1H3,(H,13,15)(H,16,17);/q;+1/p-1