1-butyl-4-[2-(4-heptylphenyl)ethynyl]benzene

Systemtic Name: 1-butyl-4-[2-(4-heptylphenyl)ethynyl]benzene Openeye Name: 1-butyl-4-[2-(4-heptylphenyl)ethynyl]benzene CAS Name: 1-butyl-4-[2-(4-heptylphenyl)ethynyl]benzene IUPAC Name: 1-butyl-4-[2-(4-heptylphenyl)ethynyl]benzene Traditional Name: 1-butyl-4-[2-(4-heptylphenyl)ethynyl]benzene Formula: C25H32 MolecularWeight: 332.52158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32/c1-3-5-7-8-9-11-23-14-18-25(19-15-23)21-20-24-16-12-22(13-17-24)10-6-4-2/h12-19H,3-11H2,1-2H3