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

Systemtic Name: 1-methyl-4-[4-[2-(4-pentoxyphenyl)ethynyl]cyclohexyl]benzene Openeye Name: 1-methyl-4-[4-[2-(4-pentoxyphenyl)ethynyl]cyclohexyl]benzene CAS Name: 1-methyl-4-[4-[2-(4-pentoxyphenyl)ethynyl]cyclohexyl]benzene IUPAC Name: 1-methyl-4-[4-[2-(4-pentoxyphenyl)ethynyl]cyclohexyl]benzene Traditional Name: 1-amoxy-4-[2-[4-(p-tolyl)cyclohexyl]ethynyl]benzene Formula: C26H32O MolecularWeight: 360.53168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C#CC2CCC(CC2)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C#CC2CCC(CC2)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H32O/c1-3-4-5-20-27-26-18-12-23(13-19-26)9-8-22-10-16-25(17-11-22)24-14-6-21(2)7-15-24/h6-7,12-15,18-19,22,25H,3-5,10-11,16-17,20H2,1-2H3