6,8-dimethoxy-3-[2-(4-methoxyphenyl)ethyl]isochromen-1-one

Systemtic Name: 6,8-dimethoxy-3-[2-(4-methoxyphenyl)ethyl]isochromen-1-one Openeye Name: 6,8-dimethoxy-3-[2-(4-methoxyphenyl)ethyl]isochromen-1-one CAS Name: 6,8-dimethoxy-3-[2-(4-methoxyphenyl)ethyl]-2-benzopyran-1-one IUPAC Name: 6,8-dimethoxy-3-[2-(4-methoxyphenyl)ethyl]isochromen-1-one Traditional Name: 6,8-dimethoxy-3-[2-(4-methoxyphenyl)ethyl]isocoumarin Formula: C20H20O5 MolecularWeight: 340.3698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC2=CC3=CC(=CC(=C3C(=O)O2)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)CCC2=CC3=CC(=CC(=C3C(=O)O2)OC)OC

InChI

InChI=1S/C20H20O5/c1-22-15-7-4-13(5-8-15)6-9-16-10-14-11-17(23-2)12-18(24-3)19(14)20(21)25-16/h4-5,7-8,10-12H,6,9H2,1-3H3