(E)-6-[(1R)-4,6-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl]hex-2-enal

Systemtic Name: (E)-6-[(1R)-4,6-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl]hex-2-enal Openeye Name: (E)-6-[(1R)-4,6-dimethoxy-3-oxo-1H-isobenzofuran-1-yl]hex-2-enal CAS Name: (E)-6-[(1R)-4,6-dimethoxy-3-oxo-1H-isobenzofuran-1-yl]-2-hexenal IUPAC Name: (E)-6-[(1R)-4,6-dimethoxy-3-oxo-1H-2-benzofuran-1-yl]hex-2-enal Traditional Name: (E)-6-[(1R)-3-keto-4,6-dimethoxy-phthalan-1-yl]hex-2-enal Formula: C16H18O5 MolecularWeight: 290.31112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)C(OC2=O)CCCC=CC=O)OC

Isomeric SMILES

COC1=CC(=C2C(=C1)[C@H](OC2=O)CCC/C=C/C=O)OC

InChI

InChI=1S/C16H18O5/c1-19-11-9-12-13(7-5-3-4-6-8-17)21-16(18)15(12)14(10-11)20-2/h4,6,8-10,13H,3,5,7H2,1-2H3/b6-4+/t13-/m1/s1