2-[(E)-hept-1-enyl]-5-[2-(4-methoxyphenyl)ethynyl]pyrazine

Systemtic Name: 2-[(E)-hept-1-enyl]-5-[2-(4-methoxyphenyl)ethynyl]pyrazine Openeye Name: 2-[(E)-hept-1-enyl]-5-[2-(4-methoxyphenyl)ethynyl]pyrazine CAS Name: 2-[(E)-hept-1-enyl]-5-[2-(4-methoxyphenyl)ethynyl]pyrazine IUPAC Name: 2-[(E)-hept-1-enyl]-5-[2-(4-methoxyphenyl)ethynyl]pyrazine Traditional Name: 2-[(E)-hept-1-enyl]-5-[2-(4-methoxyphenyl)ethynyl]pyrazine Formula: C20H22N2O MolecularWeight: 306.40148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CC1=NC=C(N=C1)C#CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCC/C=C/C1=NC=C(N=C1)C#CC2=CC=C(C=C2)OC

InChI

InChI=1S/C20H22N2O/c1-3-4-5-6-7-8-18-15-22-19(16-21-18)12-9-17-10-13-20(23-2)14-11-17/h7-8,10-11,13-16H,3-6H2,1-2H3/b8-7+