(3-oxidanylidene-1H-2-benzofuran-1-yl) 2-[4-(3-oxidanylidenecyclohexen-1-yl)phenyl]ethanoate

Systemtic Name: (3-oxidanylidene-1H-2-benzofuran-1-yl) 2-[4-(3-oxidanylidenecyclohexen-1-yl)phenyl]ethanoate Openeye Name: (3-oxo-1H-isobenzofuran-1-yl) 2-[4-(3-oxocyclohexen-1-yl)phenyl]acetate CAS Name: 2-[4-(3-oxo-1-cyclohexenyl)phenyl]acetic acid (3-oxo-1H-isobenzofuran-1-yl) ester IUPAC Name: (3-oxo-1H-2-benzofuran-1-yl) 2-[4-(3-oxocyclohexen-1-yl)phenyl]acetate Traditional Name: 2-[4-(3-ketocyclohexen-1-yl)phenyl]acetic acid phthalidyl ester Formula: C22H18O5 MolecularWeight: 362.37532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC(=O)C1)C2=CC=C(C=C2)CC(=O)OC3C4=CC=CC=C4C(=O)O3

Isomeric SMILES

C1CC(=CC(=O)C1)C2=CC=C(C=C2)CC(=O)OC3C4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C22H18O5/c23-17-5-3-4-16(13-17)15-10-8-14(9-11-15)12-20(24)26-22-19-7-2-1-6-18(19)21(25)27-22/h1-2,6-11,13,22H,3-5,12H2