1-dodecoxy-4-[4-[4-(4-methylphenyl)phenyl]buta-1,3-diynyl]-2-penta-1,3-diynyl-benzene

Systemtic Name: 1-dodecoxy-4-[4-[4-(4-methylphenyl)phenyl]buta-1,3-diynyl]-2-penta-1,3-diynyl-benzene Openeye Name: 1-dodecoxy-2-penta-1,3-diynyl-4-[4-[4-(p-tolyl)phenyl]buta-1,3-diynyl]benzene CAS Name: 1-dodecoxy-4-[4-[4-(4-methylphenyl)phenyl]buta-1,3-diynyl]-2-penta-1,3-diynylbenzene IUPAC Name: 1-dodecoxy-4-[4-[4-(4-methylphenyl)phenyl]buta-1,3-diynyl]-2-penta-1,3-diynylbenzene Traditional Name: 1-lauryloxy-2-penta-1,3-diynyl-4-[4-[4-(p-tolyl)phenyl]buta-1,3-diynyl]benzene Formula: C40H42O MolecularWeight: 538.76088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C=C1)C#CC#CC2=CC=C(C=C2)C3=CC=C(C=C3)C)C#CC#CC

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C=C1)C#CC#CC2=CC=C(C=C2)C3=CC=C(C=C3)C)C#CC#CC

InChI

InChI=1S/C40H42O/c1-4-6-8-9-10-11-12-13-14-18-32-41-40-31-26-36(33-39(40)21-15-7-5-2)20-17-16-19-35-24-29-38(30-25-35)37-27-22-34(3)23-28-37/h22-31,33H,4,6,8-14,18,32H2,1-3H3