5-methoxy-2-[2-(4-pentylphenyl)ethynyl]pyrimidine

Systemtic Name: 5-methoxy-2-[2-(4-pentylphenyl)ethynyl]pyrimidine Openeye Name: 5-methoxy-2-[2-(4-pentylphenyl)ethynyl]pyrimidine CAS Name: 5-methoxy-2-[2-(4-pentylphenyl)ethynyl]pyrimidine IUPAC Name: 5-methoxy-2-[2-(4-pentylphenyl)ethynyl]pyrimidine Traditional Name: 2-[2-(4-amylphenyl)ethynyl]-5-methoxy-pyrimidine Formula: C18H20N2O MolecularWeight: 280.3642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=N2)OC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=N2)OC

InChI

InChI=1S/C18H20N2O/c1-3-4-5-6-15-7-9-16(10-8-15)11-12-18-19-13-17(21-2)14-20-18/h7-10,13-14H,3-6H2,1-2H3