2-[2-(4-heptylphenyl)ethynyl]-5-methyl-pyridine

Systemtic Name: 2-[2-(4-heptylphenyl)ethynyl]-5-methyl-pyridine Openeye Name: 2-[2-(4-heptylphenyl)ethynyl]-5-methyl-pyridine CAS Name: 2-[2-(4-heptylphenyl)ethynyl]-5-methylpyridine IUPAC Name: 2-[2-(4-heptylphenyl)ethynyl]-5-methylpyridine Traditional Name: 2-[2-(4-heptylphenyl)ethynyl]-5-methyl-pyridine Formula: C21H25N MolecularWeight: 291.4299

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=C2)C

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=C2)C

InChI

InChI=1S/C21H25N/c1-3-4-5-6-7-8-19-10-12-20(13-11-19)14-16-21-15-9-18(2)17-22-21/h9-13,15,17H,3-8H2,1-2H3