phenyl 4-[2-(4-phenylphenyl)ethynyl]benzoate

Systemtic Name: phenyl 4-[2-(4-phenylphenyl)ethynyl]benzoate Openeye Name: phenyl 4-[2-(4-phenylphenyl)ethynyl]benzoate CAS Name: 4-[2-(4-phenylphenyl)ethynyl]benzoic acid phenyl ester IUPAC Name: phenyl 4-[2-(4-phenylphenyl)ethynyl]benzoate Traditional Name: 4-[2-(4-phenylphenyl)ethynyl]benzoic acid phenyl ester Formula: C27H18O2 MolecularWeight: 374.43062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3=CC=C(C=C3)C(=O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3=CC=C(C=C3)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C27H18O2/c28-27(29-26-9-5-2-6-10-26)25-19-15-22(16-20-25)12-11-21-13-17-24(18-14-21)23-7-3-1-4-8-23/h1-10,13-20H