5-(3-iodanylpropanoylamino)-2-methyl-4-oxidanyl-benzoic acid

Systemtic Name: 5-(3-iodanylpropanoylamino)-2-methyl-4-oxidanyl-benzoic acid Openeye Name: 4-hydroxy-5-(3-iodopropanoylamino)-2-methyl-benzoic acid CAS Name: 4-hydroxy-5-[(3-iodo-1-oxopropyl)amino]-2-methylbenzoic acid IUPAC Name: 4-hydroxy-5-(3-iodopropanoylamino)-2-methylbenzoic acid Traditional Name: 4-hydroxy-5-(3-iodopropanoylamino)-2-methyl-benzoic acid Formula: C11H12INO4 MolecularWeight: 349.12175

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)O)NC(=O)CCI)O

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)O)NC(=O)CCI)O

InChI

InChI=1S/C11H12INO4/c1-6-4-9(14)8(5-7(6)11(16)17)13-10(15)2-3-12/h4-5,14H,2-3H2,1H3,(H,13,15)(H,16,17)