ethyl 2-[2-(4-methoxyphenyl)ethynyl]-4-methyl-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[2-(4-methoxyphenyl)ethynyl]-4-methyl-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-[2-(4-methoxyphenyl)ethynyl]-4-methyl-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carboxylate CAS Name: 2-[2-(4-methoxyphenyl)ethynyl]-4-methyl-6-(3,4,5-trimethoxyphenyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-methoxyphenyl)ethynyl]-4-methyl-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carboxylate Traditional Name: 2-[2-(4-methoxyphenyl)ethynyl]-4-methyl-6-(3,4,5-trimethoxyphenyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C26H26N2O6 MolecularWeight: 462.49444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1C)C#CC2=CC=C(C=C2)OC)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1C)C#CC2=CC=C(C=C2)OC)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C26H26N2O6/c1-7-34-26(29)23-16(2)27-22(13-10-17-8-11-19(30-3)12-9-17)28-24(23)18-14-20(31-4)25(33-6)21(15-18)32-5/h8-9,11-12,14-15H,7H2,1-6H3