1-butyl-4-[(E)-6-(4-propoxyphenyl)hex-3-en-1,5-diynyl]benzene

Systemtic Name: 1-butyl-4-[(E)-6-(4-propoxyphenyl)hex-3-en-1,5-diynyl]benzene Openeye Name: 1-butyl-4-[(E)-6-(4-propoxyphenyl)hex-3-en-1,5-diynyl]benzene CAS Name: 1-butyl-4-[(E)-6-(4-propoxyphenyl)hex-3-en-1,5-diynyl]benzene IUPAC Name: 1-butyl-4-[(E)-6-(4-propoxyphenyl)hex-3-en-1,5-diynyl]benzene Traditional Name: 1-butyl-4-[(E)-6-(4-propoxyphenyl)hex-3-en-1,5-diynyl]benzene Formula: C25H26O MolecularWeight: 342.47334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C#CC=CC#CC2=CC=C(C=C2)OCCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C#C/C=C/C#CC2=CC=C(C=C2)OCCC

InChI

InChI=1S/C25H26O/c1-3-5-10-22-13-15-23(16-14-22)11-8-6-7-9-12-24-17-19-25(20-18-24)26-21-4-2/h6-7,13-20H,3-5,10,21H2,1-2H3/b7-6+