1-methyl-4-[4-(4-octoxyphenyl)buta-1,3-diynyl]benzene

Systemtic Name: 1-methyl-4-[4-(4-octoxyphenyl)buta-1,3-diynyl]benzene Openeye Name: 1-methyl-4-[4-(4-octoxyphenyl)buta-1,3-diynyl]benzene CAS Name: 1-methyl-4-[4-(4-octoxyphenyl)buta-1,3-diynyl]benzene IUPAC Name: 1-methyl-4-[4-(4-octoxyphenyl)buta-1,3-diynyl]benzene Traditional Name: 1-methyl-4-[4-(4-octoxyphenyl)buta-1,3-diynyl]benzene Formula: C25H28O MolecularWeight: 344.48922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C#CC#CC2=CC=C(C=C2)C

InChI

InChI=1S/C25H28O/c1-3-4-5-6-7-10-21-26-25-19-17-24(18-20-25)12-9-8-11-23-15-13-22(2)14-16-23/h13-20H,3-7,10,21H2,1-2H3