methyl 4-(4-methoxycarbonylphenyl)-3-[2-(4-methoxyphenyl)ethynyl]benzoate

Systemtic Name: methyl 4-(4-methoxycarbonylphenyl)-3-[2-(4-methoxyphenyl)ethynyl]benzoate Openeye Name: methyl 4-(4-methoxycarbonylphenyl)-3-[2-(4-methoxyphenyl)ethynyl]benzoate CAS Name: 4-(4-methoxycarbonylphenyl)-3-[2-(4-methoxyphenyl)ethynyl]benzoic acid methyl ester IUPAC Name: methyl 4-(4-methoxycarbonylphenyl)-3-[2-(4-methoxyphenyl)ethynyl]benzoate Traditional Name: 4-(4-carbomethoxyphenyl)-3-[2-(4-methoxyphenyl)ethynyl]benzoic acid methyl ester Formula: C25H20O5 MolecularWeight: 400.4233

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C#CC2=C(C=CC(=C2)C(=O)OC)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C#CC2=C(C=CC(=C2)C(=O)OC)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C25H20O5/c1-28-22-13-5-17(6-14-22)4-7-20-16-21(25(27)30-3)12-15-23(20)18-8-10-19(11-9-18)24(26)29-2/h5-6,8-16H,1-3H3