ethyl 3-[2-(2-phenylethynyl)phenyl]butanoate

Systemtic Name: ethyl 3-[2-(2-phenylethynyl)phenyl]butanoate Openeye Name: ethyl 3-[2-(2-phenylethynyl)phenyl]butanoate CAS Name: 3-[2-(2-phenylethynyl)phenyl]butanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(2-phenylethynyl)phenyl]butanoate Traditional Name: 3-[2-(2-phenylethynyl)phenyl]butyric acid ethyl ester Formula: C20H20O2 MolecularWeight: 292.3716

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)C1=CC=CC=C1C#CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC(C)C1=CC=CC=C1C#CC2=CC=CC=C2

InChI

InChI=1S/C20H20O2/c1-3-22-20(21)15-16(2)19-12-8-7-11-18(19)14-13-17-9-5-4-6-10-17/h4-12,16H,3,15H2,1-2H3