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

Systemtic Name: 1-[2-(4-butylcyclohexyl)ethynyl]-4-(4-heptoxyphenyl)benzene Openeye Name: 1-[2-(4-butylcyclohexyl)ethynyl]-4-(4-heptoxyphenyl)benzene CAS Name: 1-[2-(4-butylcyclohexyl)ethynyl]-4-(4-heptoxyphenyl)benzene IUPAC Name: 1-[2-(4-butylcyclohexyl)ethynyl]-4-(4-heptoxyphenyl)benzene Traditional Name: 1-[2-(4-butylcyclohexyl)ethynyl]-4-(4-heptoxyphenyl)benzene Formula: C31H42O MolecularWeight: 430.66458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3CCC(CC3)CCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3CCC(CC3)CCCC

InChI

InChI=1S/C31H42O/c1-3-5-7-8-9-25-32-31-23-21-30(22-24-31)29-19-17-28(18-20-29)16-15-27-13-11-26(12-14-27)10-6-4-2/h17-24,26-27H,3-14,25H2,1-2H3