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

Systemtic Name: 1-[(1E,5E)-6-(4-butylcyclohexyl)hexa-1,5-dien-3-ynyl]-4-pentoxy-benzene Openeye Name: 1-[(1E,5E)-6-(4-butylcyclohexyl)hexa-1,5-dien-3-ynyl]-4-pentoxy-benzene CAS Name: 1-[(1E,5E)-6-(4-butylcyclohexyl)hexa-1,5-dien-3-ynyl]-4-pentoxybenzene IUPAC Name: 1-[(1E,5E)-6-(4-butylcyclohexyl)hexa-1,5-dien-3-ynyl]-4-pentoxybenzene Traditional Name: 1-amoxy-4-[(1E,5E)-6-(4-butylcyclohexyl)hexa-1,5-dien-3-ynyl]benzene Formula: C27H38O MolecularWeight: 378.59002

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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=C/C2CCC(CC2)CCCC

InChI

InChI=1S/C27H38O/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/h9-10,13-14,19-22,24-25H,3-6,11-12,15-18,23H2,1-2H3/b13-9+,14-10+