ethyl 3,5-bis[2-(4-ethoxyphenyl)ethynyl]-4-[(4-methoxyphenyl)methoxy]benzoate

Systemtic Name: ethyl 3,5-bis[2-(4-ethoxyphenyl)ethynyl]-4-[(4-methoxyphenyl)methoxy]benzoate Openeye Name: ethyl 3,5-bis[2-(4-ethoxyphenyl)ethynyl]-4-[(4-methoxyphenyl)methoxy]benzoate CAS Name: 3,5-bis[2-(4-ethoxyphenyl)ethynyl]-4-[(4-methoxyphenyl)methoxy]benzoic acid ethyl ester IUPAC Name: ethyl 3,5-bis[2-(4-ethoxyphenyl)ethynyl]-4-[(4-methoxyphenyl)methoxy]benzoate Traditional Name: 4-p-anisyloxy-3,5-bis(2-p-phenetylethynyl)benzoic acid ethyl ester Formula: C37H34O6 MolecularWeight: 574.66226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C#CC2=CC(=CC(=C2OCC3=CC=C(C=C3)OC)C#CC4=CC=C(C=C4)OCC)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C#CC2=CC(=CC(=C2OCC3=CC=C(C=C3)OC)C#CC4=CC=C(C=C4)OCC)C(=O)OCC

InChI

InChI=1S/C37H34O6/c1-5-40-34-20-10-27(11-21-34)8-16-30-24-32(37(38)42-7-3)25-31(17-9-28-12-22-35(23-13-28)41-6-2)36(30)43-26-29-14-18-33(39-4)19-15-29/h10-15,18-25H,5-7,26H2,1-4H3