[7-methoxy-1,7-bis(oxidanylidene)-5-(phenylcarbonyloxy)heptan-3-yl] benzoate

Systemtic Name: [7-methoxy-1,7-bis(oxidanylidene)-5-(phenylcarbonyloxy)heptan-3-yl] benzoate Openeye Name: [3-benzoyloxy-5-methoxy-5-oxo-1-(2-oxoethyl)pentyl] benzoate CAS Name: benzoic acid (5-benzoyloxy-7-methoxy-1,7-dioxoheptan-3-yl) ester IUPAC Name: (5-benzoyloxy-7-methoxy-1,7-dioxoheptan-3-yl) benzoate Traditional Name: benzoic acid [3-benzoyloxy-5-keto-1-(2-ketoethyl)-5-methoxy-pentyl] ester Formula: C22H22O7 MolecularWeight: 398.40588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC(CC=O)OC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CC(CC(CC=O)OC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H22O7/c1-27-20(24)15-19(29-22(26)17-10-6-3-7-11-17)14-18(12-13-23)28-21(25)16-8-4-2-5-9-16/h2-11,13,18-19H,12,14-15H2,1H3