4-[(3-iodanyl-2-oxidanyl-propanoyl)amino]-3-methyl-benzoic acid

Systemtic Name: 4-[(3-iodanyl-2-oxidanyl-propanoyl)amino]-3-methyl-benzoic acid Openeye Name: 4-[(2-hydroxy-3-iodo-propanoyl)amino]-3-methyl-benzoic acid CAS Name: 4-[(2-hydroxy-3-iodo-1-oxopropyl)amino]-3-methylbenzoic acid IUPAC Name: 4-[(2-hydroxy-3-iodopropanoyl)amino]-3-methylbenzoic acid Traditional Name: 4-[(2-hydroxy-3-iodo-propanoyl)amino]-3-methyl-benzoic acid Formula: C11H12INO4 MolecularWeight: 349.12175

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C(CI)O

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C(CI)O

InChI

InChI=1S/C11H12INO4/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)