2-heptyl-6-[2-(4-octylphenyl)ethynyl]naphthalene

Systemtic Name: 2-heptyl-6-[2-(4-octylphenyl)ethynyl]naphthalene Openeye Name: 2-heptyl-6-[2-(4-octylphenyl)ethynyl]naphthalene CAS Name: 2-heptyl-6-[2-(4-octylphenyl)ethynyl]naphthalene IUPAC Name: 2-heptyl-6-[2-(4-octylphenyl)ethynyl]naphthalene Traditional Name: 2-heptyl-6-[2-(4-octylphenyl)ethynyl]naphthalene Formula: C33H42 MolecularWeight: 438.68658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H42/c1-3-5-7-9-11-12-14-28-16-18-29(19-17-28)20-21-31-23-25-32-26-30(22-24-33(32)27-31)15-13-10-8-6-4-2/h16-19,22-27H,3-15H2,1-2H3