2-[2-(4-butylphenyl)ethynyl]-5-propoxy-pyrimidine

Systemtic Name: 2-[2-(4-butylphenyl)ethynyl]-5-propoxy-pyrimidine Openeye Name: 2-[2-(4-butylphenyl)ethynyl]-5-propoxy-pyrimidine CAS Name: 2-[2-(4-butylphenyl)ethynyl]-5-propoxypyrimidine IUPAC Name: 2-[2-(4-butylphenyl)ethynyl]-5-propoxypyrimidine Traditional Name: 2-[2-(4-butylphenyl)ethynyl]-5-propoxy-pyrimidine Formula: C19H22N2O MolecularWeight: 294.39078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C#CC2=NC=C(C=N2)OCCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C#CC2=NC=C(C=N2)OCCC

InChI

InChI=1S/C19H22N2O/c1-3-5-6-16-7-9-17(10-8-16)11-12-19-20-14-18(15-21-19)22-13-4-2/h7-10,14-15H,3-6,13H2,1-2H3