4-(2-phenylethynyl)-2-phenylmethoxy-benzoic acid

Systemtic Name: 4-(2-phenylethynyl)-2-phenylmethoxy-benzoic acid Openeye Name: 2-benzyloxy-4-(2-phenylethynyl)benzoic acid CAS Name: 4-(2-phenylethynyl)-2-phenylmethoxybenzoic acid IUPAC Name: 4-(2-phenylethynyl)-2-phenylmethoxybenzoic acid Traditional Name: 2-benzoxy-4-(2-phenylethynyl)benzoic acid Formula: C22H16O3 MolecularWeight: 328.36064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=CC(=C2)C#CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=CC(=C2)C#CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H16O3/c23-22(24)20-14-13-18(12-11-17-7-3-1-4-8-17)15-21(20)25-16-19-9-5-2-6-10-19/h1-10,13-15H,16H2,(H,23,24)