ethyl 2-(4-methylphenyl)-7-[2-(4-methylphenyl)ethynyl]-1-benzofuran-5-carboxylate

Systemtic Name: ethyl 2-(4-methylphenyl)-7-[2-(4-methylphenyl)ethynyl]-1-benzofuran-5-carboxylate Openeye Name: ethyl 2-(p-tolyl)-7-[2-(p-tolyl)ethynyl]benzofuran-5-carboxylate CAS Name: 2-(4-methylphenyl)-7-[2-(4-methylphenyl)ethynyl]-5-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-methylphenyl)-7-[2-(4-methylphenyl)ethynyl]-1-benzofuran-5-carboxylate Traditional Name: 2-(p-tolyl)-7-[2-(p-tolyl)ethynyl]benzofuran-5-carboxylic acid ethyl ester Formula: C27H22O3 MolecularWeight: 394.46178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C(=C1)C#CC3=CC=C(C=C3)C)OC(=C2)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C(=C1)C#CC3=CC=C(C=C3)C)OC(=C2)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H22O3/c1-4-29-27(28)24-15-22(14-11-20-9-5-18(2)6-10-20)26-23(16-24)17-25(30-26)21-12-7-19(3)8-13-21/h5-10,12-13,15-17H,4H2,1-3H3