2-[(E)-4-[2-(4-ethenylphenyl)phenyl]but-3-en-1-ynyl]benzoic acid

Systemtic Name: 2-[(E)-4-[2-(4-ethenylphenyl)phenyl]but-3-en-1-ynyl]benzoic acid Openeye Name: 2-[(E)-4-[2-(4-vinylphenyl)phenyl]but-3-en-1-ynyl]benzoic acid CAS Name: 2-[(E)-4-[2-(4-ethenylphenyl)phenyl]but-3-en-1-ynyl]benzoic acid IUPAC Name: 2-[(E)-4-[2-(4-ethenylphenyl)phenyl]but-3-en-1-ynyl]benzoic acid Traditional Name: 2-[(E)-4-[2-(4-vinylphenyl)phenyl]but-3-en-1-ynyl]benzoic acid Formula: C25H18O2 MolecularWeight: 350.40922

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=C(C=C1)C2=CC=CC=C2C=CC#CC3=CC=CC=C3C(=O)O

Isomeric SMILES

C=CC1=CC=C(C=C1)C2=CC=CC=C2/C=C/C#CC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C25H18O2/c1-2-19-15-17-22(18-16-19)23-13-7-5-10-20(23)9-3-4-11-21-12-6-8-14-24(21)25(26)27/h2-3,5-10,12-18H,1H2,(H,26,27)/b9-3+