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

Systemtic Name: 5-butyl-2-[2-(4-pentoxyphenyl)ethynyl]pyridine Openeye Name: 5-butyl-2-[2-(4-pentoxyphenyl)ethynyl]pyridine CAS Name: 5-butyl-2-[2-(4-pentoxyphenyl)ethynyl]pyridine IUPAC Name: 5-butyl-2-[2-(4-pentoxyphenyl)ethynyl]pyridine Traditional Name: 2-[2-(4-amoxyphenyl)ethynyl]-5-butyl-pyridine Formula: C22H27NO MolecularWeight: 321.45588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C#CC2=NC=C(C=C2)CCCC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C#CC2=NC=C(C=C2)CCCC

InChI

InChI=1S/C22H27NO/c1-3-5-7-17-24-22-15-11-19(12-16-22)9-13-21-14-10-20(18-23-21)8-6-4-2/h10-12,14-16,18H,3-8,17H2,1-2H3