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1,4-bis[2-(4-octylphenyl)ethynyl]benzene

1,4-bis[2-(4-octylphenyl)ethynyl]benzene

Systemtic Name:1,4-bis[2-(4-octylphenyl)ethynyl]benzene
Openeye Name:1,4-bis[2-(4-octylphenyl)ethynyl]benzene
CAS Name:1,4-bis[2-(4-octylphenyl)ethynyl]benzene
IUPAC Name:1,4-bis[2-(4-octylphenyl)ethynyl]benzene
Traditional Name:1,4-bis[2-(4-octylphenyl)ethynyl]benzene
Formula: C38H46
MolecularWeight: 502.77184
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC=C(C=C3)CCCCCCCC


Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC=C(C=C3)CCCCCCCC


InChI

InChI=1S/C38H46/c1-3-5-7-9-11-13-15-33-17-21-35(22-18-33)25-27-37-29-31-38(32-30-37)28-26-36-23-19-34(20-24-36)16-14-12-10-8-6-4-2/h17-24,29-32H,3-16H2,1-2H3


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