4-[2-benzofuran-1-yl-(4-iodophenyl)methoxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-benzofuran-1-yl-(4-iodophenyl)methoxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(4-iodophenyl)-isobenzofuran-1-yl-methoxy]-4-oxo-butanoic acid CAS Name: 4-[(4-iodophenyl)-(1-isobenzofuranyl)methoxy]-4-oxobutanoic acid IUPAC Name: 4-[2-benzofuran-1-yl-(4-iodophenyl)methoxy]-4-oxobutanoic acid Traditional Name: 4-[(4-iodophenyl)-isobenzofuran-1-yl-methoxy]-4-keto-butyric acid Formula: C19H15IO5 MolecularWeight: 450.22387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=COC(=C2C=C1)C(C3=CC=C(C=C3)I)OC(=O)CCC(=O)O

Isomeric SMILES

C1=CC2=COC(=C2C=C1)C(C3=CC=C(C=C3)I)OC(=O)CCC(=O)O

InChI

InChI=1S/C19H15IO5/c20-14-7-5-12(6-8-14)18(25-17(23)10-9-16(21)22)19-15-4-2-1-3-13(15)11-24-19/h1-8,11,18H,9-10H2,(H,21,22)