[5-methoxy-2-(phenylcarbonyl)phenyl] 2,3-dihydro-1-benzofuran-5-sulfonate

Systemtic Name: [5-methoxy-2-(phenylcarbonyl)phenyl] 2,3-dihydro-1-benzofuran-5-sulfonate Openeye Name: (2-benzoyl-5-methoxy-phenyl) 2,3-dihydrobenzofuran-5-sulfonate CAS Name: 2,3-dihydrobenzofuran-5-sulfonic acid (2-benzoyl-5-methoxyphenyl) ester IUPAC Name: (2-benzoyl-5-methoxyphenyl) 2,3-dihydro-1-benzofuran-5-sulfonate Traditional Name: coumaran-5-sulfonic acid (2-benzoyl-5-methoxy-phenyl) ester Formula: C22H18O6S MolecularWeight: 410.43972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)OS(=O)(=O)C3=CC4=C(C=C3)OCC4

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)OS(=O)(=O)C3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C22H18O6S/c1-26-17-7-9-19(22(23)15-5-3-2-4-6-15)21(14-17)28-29(24,25)18-8-10-20-16(13-18)11-12-27-20/h2-10,13-14H,11-12H2,1H3