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

Systemtic Name: 1,4-bis[2-(4-heptylphenyl)ethynyl]benzene Openeye Name: 1,4-bis[2-(4-heptylphenyl)ethynyl]benzene CAS Name: 1,4-bis[2-(4-heptylphenyl)ethynyl]benzene IUPAC Name: 1,4-bis[2-(4-heptylphenyl)ethynyl]benzene Traditional Name: 1,4-bis[2-(4-heptylphenyl)ethynyl]benzene Formula: C36H42 MolecularWeight: 474.71868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC=C(C=C3)CCCCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C#CC3=CC=C(C=C3)CCCCCCC

InChI

InChI=1S/C36H42/c1-3-5-7-9-11-13-31-15-19-33(20-16-31)23-25-35-27-29-36(30-28-35)26-24-34-21-17-32(18-22-34)14-12-10-8-6-4-2/h15-22,27-30H,3-14H2,1-2H3