4-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]benzoic acid

Systemtic Name: 4-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]benzoic acid Openeye Name: 4-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]benzoic acid CAS Name: 4-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]benzoic acid IUPAC Name: 4-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]benzoic acid Traditional Name: 4-[4-[2-(4-methoxyphenyl)ethynyl]phenyl]benzoic acid Formula: C22H16O3 MolecularWeight: 328.36064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H16O3/c1-25-21-14-6-17(7-15-21)3-2-16-4-8-18(9-5-16)19-10-12-20(13-11-19)22(23)24/h4-15H,1H3,(H,23,24)