methyl 4-[2-[4-(2-phenylethynyl)phenyl]ethynyl]benzoate

Systemtic Name: methyl 4-[2-[4-(2-phenylethynyl)phenyl]ethynyl]benzoate Openeye Name: methyl 4-[2-[4-(2-phenylethynyl)phenyl]ethynyl]benzoate CAS Name: 4-[2-[4-(2-phenylethynyl)phenyl]ethynyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[4-(2-phenylethynyl)phenyl]ethynyl]benzoate Traditional Name: 4-[2-[4-(2-phenylethynyl)phenyl]ethynyl]benzoic acid methyl ester Formula: C24H16O2 MolecularWeight: 336.38264

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC=CC=C3

InChI

InChI=1S/C24H16O2/c1-26-24(25)23-17-15-22(16-18-23)14-13-21-11-9-20(10-12-21)8-7-19-5-3-2-4-6-19/h2-6,9-12,15-18H,1H3