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1-heptyl-4-[4-[2-(4-octylphenyl)ethynyl]cyclohexyl]benzene

1-heptyl-4-[4-[2-(4-octylphenyl)ethynyl]cyclohexyl]benzene

Systemtic Name:1-heptyl-4-[4-[2-(4-octylphenyl)ethynyl]cyclohexyl]benzene
Openeye Name:1-heptyl-4-[4-[2-(4-octylphenyl)ethynyl]cyclohexyl]benzene
CAS Name:1-heptyl-4-[4-[2-(4-octylphenyl)ethynyl]cyclohexyl]benzene
IUPAC Name:1-heptyl-4-[4-[2-(4-octylphenyl)ethynyl]cyclohexyl]benzene
Traditional Name:1-heptyl-4-[4-[2-(4-octylphenyl)ethynyl]cyclohexyl]benzene
Formula: C35H50
MolecularWeight: 470.7715
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C#CC2CCC(CC2)C3=CC=C(C=C3)CCCCCCC


Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C#CC2CCC(CC2)C3=CC=C(C=C3)CCCCCCC


InChI

InChI=1S/C35H50/c1-3-5-7-9-11-13-14-30-16-18-32(19-17-30)20-21-33-24-28-35(29-25-33)34-26-22-31(23-27-34)15-12-10-8-6-4-2/h16-19,22-23,26-27,33,35H,3-15,24-25,28-29H2,1-2H3


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