1-butyl-4-[2-[4-(4-pentoxyphenyl)cyclohexyl]ethynyl]benzene

Systemtic Name: 1-butyl-4-[2-[4-(4-pentoxyphenyl)cyclohexyl]ethynyl]benzene Openeye Name: 1-butyl-4-[2-[4-(4-pentoxyphenyl)cyclohexyl]ethynyl]benzene CAS Name: 1-butyl-4-[2-[4-(4-pentoxyphenyl)cyclohexyl]ethynyl]benzene IUPAC Name: 1-butyl-4-[2-[4-(4-pentoxyphenyl)cyclohexyl]ethynyl]benzene Traditional Name: 1-amoxy-4-[4-[2-(4-butylphenyl)ethynyl]cyclohexyl]benzene Formula: C29H38O MolecularWeight: 402.61142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2CCC(CC2)C#CC3=CC=C(C=C3)CCCC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2CCC(CC2)C#CC3=CC=C(C=C3)CCCC

InChI

InChI=1S/C29H38O/c1-3-5-7-23-30-29-21-19-28(20-22-29)27-17-15-26(16-18-27)14-13-25-11-9-24(10-12-25)8-6-4-2/h9-12,19-22,26-27H,3-8,15-18,23H2,1-2H3