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

Systemtic Name: 4-[(E)-4-[2-(4-chlorophenyl)phenyl]but-3-en-1-ynyl]benzoic acid Openeye Name: 4-[(E)-4-[2-(4-chlorophenyl)phenyl]but-3-en-1-ynyl]benzoic acid CAS Name: 4-[(E)-4-[2-(4-chlorophenyl)phenyl]but-3-en-1-ynyl]benzoic acid IUPAC Name: 4-[(E)-4-[2-(4-chlorophenyl)phenyl]but-3-en-1-ynyl]benzoic acid Traditional Name: 4-[(E)-4-[2-(4-chlorophenyl)phenyl]but-3-en-1-ynyl]benzoic acid Formula: C23H15ClO2 MolecularWeight: 358.817

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C#CC2=CC=C(C=C2)C(=O)O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H15ClO2/c24-21-15-13-19(14-16-21)22-8-4-3-7-18(22)6-2-1-5-17-9-11-20(12-10-17)23(25)26/h2-4,6-16H,(H,25,26)/b6-2+