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

Systemtic Name: 5-chloranyl-2-[2-(4-pentylphenyl)ethynyl]pyrimidine Openeye Name: 5-chloro-2-[2-(4-pentylphenyl)ethynyl]pyrimidine CAS Name: 5-chloro-2-[2-(4-pentylphenyl)ethynyl]pyrimidine IUPAC Name: 5-chloro-2-[2-(4-pentylphenyl)ethynyl]pyrimidine Traditional Name: 2-[2-(4-amylphenyl)ethynyl]-5-chloro-pyrimidine Formula: C17H17ClN2 MolecularWeight: 284.78328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClN2/c1-2-3-4-5-14-6-8-15(9-7-14)10-11-17-19-12-16(18)13-20-17/h6-9,12-13H,2-5H2,1H3