6-(4-iodophenyl)-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(4-iodophenyl)-6-oxidanylidene-hexanoic acid Openeye Name: 6-(4-iodophenyl)-6-oxo-hexanoic acid CAS Name: 6-(4-iodophenyl)-6-oxohexanoic acid IUPAC Name: 6-(4-iodophenyl)-6-oxohexanoic acid Traditional Name: 6-(4-iodophenyl)-6-keto-hexanoic acid Formula: C12H13IO3 MolecularWeight: 332.13429

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCCC(=O)O)I

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCCC(=O)O)I

InChI

InChI=1S/C12H13IO3/c13-10-7-5-9(6-8-10)11(14)3-1-2-4-12(15)16/h5-8H,1-4H2,(H,15,16)