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

Systemtic Name: 1-[(E)-6-(4-butylcyclohexyl)hex-3-en-1,5-diynyl]-4-pentoxy-benzene Openeye Name: 1-[(E)-6-(4-butylcyclohexyl)hex-3-en-1,5-diynyl]-4-pentoxy-benzene CAS Name: 1-[(E)-6-(4-butylcyclohexyl)hex-3-en-1,5-diynyl]-4-pentoxybenzene IUPAC Name: 1-[(E)-6-(4-butylcyclohexyl)hex-3-en-1,5-diynyl]-4-pentoxybenzene Traditional Name: 1-amoxy-4-[(E)-6-(4-butylcyclohexyl)hex-3-en-1,5-diynyl]benzene Formula: C27H36O MolecularWeight: 376.57414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C#CC=CC#CC2CCC(CC2)CCCC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C#C/C=C/C#CC2CCC(CC2)CCCC

InChI

InChI=1S/C27H36O/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/h7-8,19-22,24-25H,3-6,11-12,15-18,23H2,1-2H3/b8-7+