3-ethoxy-5-iodanyl-4-propoxy-benzoic acid

Systemtic Name: 3-ethoxy-5-iodanyl-4-propoxy-benzoic acid Openeye Name: 3-ethoxy-5-iodo-4-propoxy-benzoic acid CAS Name: 3-ethoxy-5-iodo-4-propoxybenzoic acid IUPAC Name: 3-ethoxy-5-iodo-4-propoxybenzoic acid Traditional Name: 3-ethoxy-5-iodo-4-propoxy-benzoic acid Formula: C12H15IO4 MolecularWeight: 350.14957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1I)C(=O)O)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1I)C(=O)O)OCC

InChI

InChI=1S/C12H15IO4/c1-3-5-17-11-9(13)6-8(12(14)15)7-10(11)16-4-2/h6-7H,3-5H2,1-2H3,(H,14,15)