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

Systemtic Name: 4-[4-[2-(4-propoxyphenyl)ethynyl]phenyl]benzoic acid Openeye Name: 4-[4-[2-(4-propoxyphenyl)ethynyl]phenyl]benzoic acid CAS Name: 4-[4-[2-(4-propoxyphenyl)ethynyl]phenyl]benzoic acid IUPAC Name: 4-[4-[2-(4-propoxyphenyl)ethynyl]phenyl]benzoic acid Traditional Name: 4-[4-[2-(4-propoxyphenyl)ethynyl]phenyl]benzoic acid Formula: C24H20O3 MolecularWeight: 356.4138

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C24H20O3/c1-2-17-27-23-15-7-19(8-16-23)4-3-18-5-9-20(10-6-18)21-11-13-22(14-12-21)24(25)26/h5-16H,2,17H2,1H3,(H,25,26)