3-[2-(4-phenylphenyl)ethynyl]phthalic acid

Systemtic Name: 3-[2-(4-phenylphenyl)ethynyl]phthalic acid Openeye Name: 3-[2-(4-phenylphenyl)ethynyl]phthalic acid CAS Name: 3-[2-(4-phenylphenyl)ethynyl]phthalic acid IUPAC Name: 3-[2-(4-phenylphenyl)ethynyl]phthalic acid Traditional Name: 3-[2-(4-phenylphenyl)ethynyl]phthalic acid Formula: C22H14O4 MolecularWeight: 342.34416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H14O4/c23-21(24)19-8-4-7-18(20(19)22(25)26)14-11-15-9-12-17(13-10-15)16-5-2-1-3-6-16/h1-10,12-13H,(H,23,24)(H,25,26)