5-butyl-2-[2-(4-pentylphenyl)ethynyl]pyridine

Systemtic Name: 5-butyl-2-[2-(4-pentylphenyl)ethynyl]pyridine Openeye Name: 5-butyl-2-[2-(4-pentylphenyl)ethynyl]pyridine CAS Name: 5-butyl-2-[2-(4-pentylphenyl)ethynyl]pyridine IUPAC Name: 5-butyl-2-[2-(4-pentylphenyl)ethynyl]pyridine Traditional Name: 2-[2-(4-amylphenyl)ethynyl]-5-butyl-pyridine Formula: C22H27N MolecularWeight: 305.45648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=C2)CCCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C#CC2=NC=C(C=C2)CCCC

InChI

InChI=1S/C22H27N/c1-3-5-7-9-19-10-12-20(13-11-19)14-16-22-17-15-21(18-23-22)8-6-4-2/h10-13,15,17-18H,3-9H2,1-2H3