2-[2-(4-butylphenyl)ethynyl]-5-pentoxy-pyridine

Systemtic Name: 2-[2-(4-butylphenyl)ethynyl]-5-pentoxy-pyridine Openeye Name: 2-[2-(4-butylphenyl)ethynyl]-5-pentoxy-pyridine CAS Name: 2-[2-(4-butylphenyl)ethynyl]-5-pentoxypyridine IUPAC Name: 2-[2-(4-butylphenyl)ethynyl]-5-pentoxypyridine Traditional Name: 5-amoxy-2-[2-(4-butylphenyl)ethynyl]pyridine Formula: C22H27NO MolecularWeight: 321.45588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO/c1-3-5-7-17-24-22-16-15-21(23-18-22)14-13-20-11-9-19(10-12-20)8-6-4-2/h9-12,15-16,18H,3-8,17H2,1-2H3