(4-methoxycarbonylphenyl) 3,6,6-trimethyl-4-oxidanylidene-5,7-dihydro-1-benzofuran-2-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl) 3,6,6-trimethyl-4-oxidanylidene-5,7-dihydro-1-benzofuran-2-carboxylate Openeye Name: (4-methoxycarbonylphenyl) 3,6,6-trimethyl-4-oxo-5,7-dihydrobenzofuran-2-carboxylate CAS Name: 3,6,6-trimethyl-4-oxo-5,7-dihydrobenzofuran-2-carboxylic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) 3,6,6-trimethyl-4-oxo-5,7-dihydro-1-benzofuran-2-carboxylate Traditional Name: 4-keto-3,6,6-trimethyl-5,7-dihydrobenzofuran-2-carboxylic acid (4-carbomethoxyphenyl) ester Formula: C20H20O6 MolecularWeight: 356.3692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)OC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)OC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H20O6/c1-11-16-14(21)9-20(2,3)10-15(16)26-17(11)19(23)25-13-7-5-12(6-8-13)18(22)24-4/h5-8H,9-10H2,1-4H3