7-(3-iodanylphenyl)-7-oxidanylidene-heptanoic acid

Systemtic Name: 7-(3-iodanylphenyl)-7-oxidanylidene-heptanoic acid Openeye Name: 7-(3-iodophenyl)-7-oxo-heptanoic acid CAS Name: 7-(3-iodophenyl)-7-oxoheptanoic acid IUPAC Name: 7-(3-iodophenyl)-7-oxoheptanoic acid Traditional Name: 7-(3-iodophenyl)-7-keto-enanthic acid Formula: C13H15IO3 MolecularWeight: 346.16087

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)C(=O)CCCCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)I)C(=O)CCCCCC(=O)O

InChI

InChI=1S/C13H15IO3/c14-11-6-4-5-10(9-11)12(15)7-2-1-3-8-13(16)17/h4-6,9H,1-3,7-8H2,(H,16,17)