[2-(2-phenylethynyl)phenyl] 4-ethanoylbenzoate

Systemtic Name: [2-(2-phenylethynyl)phenyl] 4-ethanoylbenzoate Openeye Name: [2-(2-phenylethynyl)phenyl] 4-acetylbenzoate CAS Name: 4-acetylbenzoic acid [2-(2-phenylethynyl)phenyl] ester IUPAC Name: [2-(2-phenylethynyl)phenyl] 4-acetylbenzoate Traditional Name: 4-acetylbenzoic acid [2-(2-phenylethynyl)phenyl] ester Formula: C23H16O3 MolecularWeight: 340.37134

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C#CC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C(=O)OC2=CC=CC=C2C#CC3=CC=CC=C3

InChI

InChI=1S/C23H16O3/c1-17(24)19-13-15-21(16-14-19)23(25)26-22-10-6-5-9-20(22)12-11-18-7-3-2-4-8-18/h2-10,13-16H,1H3