1-[2-(4-butylcyclohexyl)ethynyl]-4-(4-pentoxyphenyl)benzene

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3CCC(CC3)CCCC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3CCC(CC3)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/h15-22,24-25H,3-12,23H2,1-2H3