4-[2-(4-methylphenyl)ethynyl]benzoic acid

Systemtic Name: 4-[2-(4-methylphenyl)ethynyl]benzoic acid Openeye Name: 4-[2-(p-tolyl)ethynyl]benzoic acid CAS Name: 4-[2-(4-methylphenyl)ethynyl]benzoic acid IUPAC Name: 4-[2-(4-methylphenyl)ethynyl]benzoic acid Traditional Name: 4-[2-(p-tolyl)ethynyl]benzoic acid Formula: C16H12O2 MolecularWeight: 236.26528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H12O2/c1-12-2-4-13(5-3-12)6-7-14-8-10-15(11-9-14)16(17)18/h2-5,8-11H,1H3,(H,17,18)