1-butyl-4-[(1E,5E)-6-(4-pentoxyphenyl)hexa-1,5-dien-3-ynyl]benzene

Systemtic Name: 1-butyl-4-[(1E,5E)-6-(4-pentoxyphenyl)hexa-1,5-dien-3-ynyl]benzene Openeye Name: 1-butyl-4-[(1E,5E)-6-(4-pentoxyphenyl)hexa-1,5-dien-3-ynyl]benzene CAS Name: 1-butyl-4-[(1E,5E)-6-(4-pentoxyphenyl)hexa-1,5-dien-3-ynyl]benzene IUPAC Name: 1-butyl-4-[(1E,5E)-6-(4-pentoxyphenyl)hexa-1,5-dien-3-ynyl]benzene Traditional Name: 1-amoxy-4-[(1E,5E)-6-(4-butylphenyl)hexa-1,5-dien-3-ynyl]benzene Formula: C27H32O MolecularWeight: 372.54238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C=CC#CC=CC2=CC=C(C=C2)CCCC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)/C=C/C#C/C=C/C2=CC=C(C=C2)CCCC

InChI

InChI=1S/C27H32O/c1-3-5-11-23-28-27-21-19-26(20-22-27)14-10-8-7-9-13-25-17-15-24(16-18-25)12-6-4-2/h9-10,13-22H,3-6,11-12,23H2,1-2H3/b13-9+,14-10+