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

Systemtic Name: (4-methylphenyl) 3,6,6-trimethyl-4-oxidanylidene-5,7-dihydro-1-benzofuran-2-carboxylate Openeye Name: p-tolyl 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-methylphenyl) ester IUPAC Name: (4-methylphenyl) 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 p-tolyl ester Formula: C19H20O4 MolecularWeight: 312.3597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=O)C2=C(C3=C(O2)CC(CC3=O)(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)OC(=O)C2=C(C3=C(O2)CC(CC3=O)(C)C)C

InChI

InChI=1S/C19H20O4/c1-11-5-7-13(8-6-11)22-18(21)17-12(2)16-14(20)9-19(3,4)10-15(16)23-17/h5-8H,9-10H2,1-4H3