3-(1-iodanylbutyl)phthalic acid

Systemtic Name: 3-(1-iodanylbutyl)phthalic acid Openeye Name: 3-(1-iodobutyl)phthalic acid CAS Name: 3-(1-iodobutyl)phthalic acid IUPAC Name: 3-(1-iodobutyl)phthalic acid Traditional Name: 3-(1-iodobutyl)phthalic acid Formula: C12H13IO4 MolecularWeight: 348.13369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC(=C1C(=O)O)C(=O)O)I

Isomeric SMILES

CCCC(C1=CC=CC(=C1C(=O)O)C(=O)O)I

InChI

InChI=1S/C12H13IO4/c1-2-4-9(13)7-5-3-6-8(11(14)15)10(7)12(16)17/h3,5-6,9H,2,4H2,1H3,(H,14,15)(H,16,17)