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

Systemtic Name: 4-[(E)-4-[2-(4-ethenylphenyl)phenyl]but-3-en-1-ynyl]benzoic acid Openeye Name: 4-[(E)-4-[2-(4-vinylphenyl)phenyl]but-3-en-1-ynyl]benzoic acid CAS Name: 4-[(E)-4-[2-(4-ethenylphenyl)phenyl]but-3-en-1-ynyl]benzoic acid IUPAC Name: 4-[(E)-4-[2-(4-ethenylphenyl)phenyl]but-3-en-1-ynyl]benzoic acid Traditional Name: 4-[(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=C(C=C3)C(=O)O

Isomeric SMILES

C=CC1=CC=C(C=C1)C2=CC=CC=C2/C=C/C#CC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C25H18O2/c1-2-19-11-15-22(16-12-19)24-10-6-5-9-21(24)8-4-3-7-20-13-17-23(18-14-20)25(26)27/h2,4-6,8-18H,1H2,(H,26,27)/b8-4+