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

Systemtic Name: 1-heptyl-4-[(E)-6-(4-pentylphenyl)hex-3-en-1,5-diynyl]benzene Openeye Name: 1-heptyl-4-[(E)-6-(4-pentylphenyl)hex-3-en-1,5-diynyl]benzene CAS Name: 1-heptyl-4-[(E)-6-(4-pentylphenyl)hex-3-en-1,5-diynyl]benzene IUPAC Name: 1-heptyl-4-[(E)-6-(4-pentylphenyl)hex-3-en-1,5-diynyl]benzene Traditional Name: 1-amyl-4-[(E)-6-(4-heptylphenyl)hex-3-en-1,5-diynyl]benzene Formula: C30H36 MolecularWeight: 396.60684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C#CC=CC#CC2=CC=C(C=C2)CCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C#C/C=C/C#CC2=CC=C(C=C2)CCCCC

InChI

InChI=1S/C30H36/c1-3-5-7-8-12-16-28-23-25-30(26-24-28)18-14-10-9-13-17-29-21-19-27(20-22-29)15-11-6-4-2/h9-10,19-26H,3-8,11-12,15-16H2,1-2H3/b10-9+