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

Systemtic Name: 1-butyl-4-[2-[4-(4-heptylcyclohexyl)cyclohexyl]ethynyl]benzene Openeye Name: 1-butyl-4-[2-[4-(4-heptylcyclohexyl)cyclohexyl]ethynyl]benzene CAS Name: 1-butyl-4-[2-[4-(4-heptylcyclohexyl)cyclohexyl]ethynyl]benzene IUPAC Name: 1-butyl-4-[2-[4-(4-heptylcyclohexyl)cyclohexyl]ethynyl]benzene Traditional Name: 1-butyl-4-[2-[4-(4-heptylcyclohexyl)cyclohexyl]ethynyl]benzene Formula: C31H48 MolecularWeight: 420.71282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)C2CCC(CC2)C#CC3=CC=C(C=C3)CCCC

Isomeric SMILES

CCCCCCCC1CCC(CC1)C2CCC(CC2)C#CC3=CC=C(C=C3)CCCC

InChI

InChI=1S/C31H48/c1-3-5-7-8-9-11-27-18-22-30(23-19-27)31-24-20-29(21-25-31)17-16-28-14-12-26(13-15-28)10-6-4-2/h12-15,27,29-31H,3-11,18-25H2,1-2H3