4-[2-(4-phenylphenyl)ethynyl]benzoic acid

Systemtic Name: 4-[2-(4-phenylphenyl)ethynyl]benzoic acid Openeye Name: 4-[2-(4-phenylphenyl)ethynyl]benzoic acid CAS Name: 4-[2-(4-phenylphenyl)ethynyl]benzoic acid IUPAC Name: 4-[2-(4-phenylphenyl)ethynyl]benzoic acid Traditional Name: 4-[2-(4-phenylphenyl)ethynyl]benzoic acid Formula: C21H14O2 MolecularWeight: 298.33466

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C21H14O2/c22-21(23)20-14-10-17(11-15-20)7-6-16-8-12-19(13-9-16)18-4-2-1-3-5-18/h1-5,8-15H,(H,22,23)