4-(2-iodanylphenyl)-4-methyl-2-oxidanylidene-pentanoic acid

Systemtic Name: 4-(2-iodanylphenyl)-4-methyl-2-oxidanylidene-pentanoic acid Openeye Name: 4-(2-iodophenyl)-4-methyl-2-oxo-pentanoic acid CAS Name: 4-(2-iodophenyl)-4-methyl-2-oxopentanoic acid IUPAC Name: 4-(2-iodophenyl)-4-methyl-2-oxopentanoic acid Traditional Name: 4-(2-iodophenyl)-2-keto-4-methyl-valeric acid Formula: C12H13IO3 MolecularWeight: 332.13429

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)C(=O)O)C1=CC=CC=C1I

Isomeric SMILES

CC(C)(CC(=O)C(=O)O)C1=CC=CC=C1I

InChI

InChI=1S/C12H13IO3/c1-12(2,7-10(14)11(15)16)8-5-3-4-6-9(8)13/h3-6H,7H2,1-2H3,(H,15,16)