[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl] 3-methyl-1-benzofuran-2-carboxylate Openeye Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-methylbenzofuran-2-carboxylate CAS Name: 3-methyl-2-benzofurancarboxylic acid [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-methyl-1-benzofuran-2-carboxylate Traditional Name: 3-methylcoumarilic acid [2-keto-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)COC(=O)C2=C(C3=CC=CC=C3O2)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)COC(=O)C2=C(C3=CC=CC=C3O2)C)C)C

InChI

InChI=1S/C21H20O4/c1-12-9-14(3)17(10-13(12)2)18(22)11-24-21(23)20-15(4)16-7-5-6-8-19(16)25-20/h5-10H,11H2,1-4H3