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

Systemtic Name: ethyl 3,5-bis[2-(4-ethoxyphenyl)ethynyl]-4-(2-methoxyethoxymethoxy)benzoate Openeye Name: ethyl 3,5-bis[2-(4-ethoxyphenyl)ethynyl]-4-(2-methoxyethoxymethoxy)benzoate CAS Name: 3,5-bis[2-(4-ethoxyphenyl)ethynyl]-4-(2-methoxyethoxymethoxy)benzoic acid ethyl ester IUPAC Name: ethyl 3,5-bis[2-(4-ethoxyphenyl)ethynyl]-4-(2-methoxyethoxymethoxy)benzoate Traditional Name: 4-(2-methoxyethoxymethoxy)-3,5-bis(2-p-phenetylethynyl)benzoic acid ethyl ester Formula: C33H34O7 MolecularWeight: 542.61886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C#CC2=CC(=CC(=C2OCOCCOC)C#CC3=CC=C(C=C3)OCC)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C#CC2=CC(=CC(=C2OCOCCOC)C#CC3=CC=C(C=C3)OCC)C(=O)OCC

InChI

InChI=1S/C33H34O7/c1-5-37-30-16-10-25(11-17-30)8-14-27-22-29(33(34)39-7-3)23-28(32(27)40-24-36-21-20-35-4)15-9-26-12-18-31(19-13-26)38-6-2/h10-13,16-19,22-23H,5-7,20-21,24H2,1-4H3