[1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 3-(ethoxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: [1-(4-methylphenyl)-1-oxidanylidene-propan-2-yl] 3-(ethoxymethyl)-1-benzofuran-2-carboxylate Openeye Name: [1-methyl-2-oxo-2-(p-tolyl)ethyl] 3-(ethoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(ethoxymethyl)-2-benzofurancarboxylic acid [1-(4-methylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-methylphenyl)-1-oxopropan-2-yl] 3-(ethoxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(ethoxymethyl)coumarilic acid [2-keto-1-methyl-2-(p-tolyl)ethyl] ester Formula: C22H22O5 MolecularWeight: 366.40708

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(OC2=CC=CC=C21)C(=O)OC(C)C(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOCC1=C(OC2=CC=CC=C21)C(=O)OC(C)C(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H22O5/c1-4-25-13-18-17-7-5-6-8-19(17)27-21(18)22(24)26-15(3)20(23)16-11-9-14(2)10-12-16/h5-12,15H,4,13H2,1-3H3