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

Systemtic Name: 2-[2-(4-butylphenyl)ethynyl]-5-chloranyl-pyrazine Openeye Name: 2-[2-(4-butylphenyl)ethynyl]-5-chloro-pyrazine CAS Name: 2-[2-(4-butylphenyl)ethynyl]-5-chloropyrazine IUPAC Name: 2-[2-(4-butylphenyl)ethynyl]-5-chloropyrazine Traditional Name: 2-[2-(4-butylphenyl)ethynyl]-5-chloro-pyrazine Formula: C16H15ClN2 MolecularWeight: 270.7567

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C#CC2=CN=C(C=N2)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)C#CC2=CN=C(C=N2)Cl

InChI

InChI=1S/C16H15ClN2/c1-2-3-4-13-5-7-14(8-6-13)9-10-15-11-19-16(17)12-18-15/h5-8,11-12H,2-4H2,1H3