2-[2-(4-butoxyphenyl)ethynyl]-5-chloranyl-pyrazine

Systemtic Name: 2-[2-(4-butoxyphenyl)ethynyl]-5-chloranyl-pyrazine Openeye Name: 2-[2-(4-butoxyphenyl)ethynyl]-5-chloro-pyrazine CAS Name: 2-[2-(4-butoxyphenyl)ethynyl]-5-chloropyrazine IUPAC Name: 2-[2-(4-butoxyphenyl)ethynyl]-5-chloropyrazine Traditional Name: 2-[2-(4-butoxyphenyl)ethynyl]-5-chloro-pyrazine Formula: C16H15ClN2O MolecularWeight: 286.7561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C#CC2=CN=C(C=N2)Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C#CC2=CN=C(C=N2)Cl

InChI

InChI=1S/C16H15ClN2O/c1-2-3-10-20-15-8-5-13(6-9-15)4-7-14-11-19-16(17)12-18-14/h5-6,8-9,11-12H,2-3,10H2,1H3