(4-phenethylphenyl) 4-[[4-(2-phenylethynyl)phenoxy]methoxy]benzoate

Systemtic Name: (4-phenethylphenyl) 4-[[4-(2-phenylethynyl)phenoxy]methoxy]benzoate Openeye Name: (4-phenethylphenyl) 4-[[4-(2-phenylethynyl)phenoxy]methoxy]benzoate CAS Name: 4-[[4-(2-phenylethynyl)phenoxy]methoxy]benzoic acid (4-phenethylphenyl) ester IUPAC Name: (4-phenethylphenyl) 4-[[4-(2-phenylethynyl)phenoxy]methoxy]benzoate Traditional Name: 4-[[4-(2-phenylethynyl)phenoxy]methoxy]benzoic acid (4-phenethylphenyl) ester Formula: C36H28O4 MolecularWeight: 524.60512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCOC4=CC=C(C=C4)C#CC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCOC4=CC=C(C=C4)C#CC5=CC=CC=C5

InChI

InChI=1S/C36H28O4/c37-36(40-35-23-17-31(18-24-35)14-12-29-9-5-2-6-10-29)32-19-25-34(26-20-32)39-27-38-33-21-15-30(16-22-33)13-11-28-7-3-1-4-8-28/h1-10,15-26H,12,14,27H2