4-hex-1-ynyl-2-[2-(4-pentylcyclohexyl)ethyl]-1-(2-phenylethynyl)benzene

Systemtic Name: 4-hex-1-ynyl-2-[2-(4-pentylcyclohexyl)ethyl]-1-(2-phenylethynyl)benzene Openeye Name: 4-hex-1-ynyl-2-[2-(4-pentylcyclohexyl)ethyl]-1-(2-phenylethynyl)benzene CAS Name: 4-hex-1-ynyl-2-[2-(4-pentylcyclohexyl)ethyl]-1-(2-phenylethynyl)benzene IUPAC Name: 4-hex-1-ynyl-2-[2-(4-pentylcyclohexyl)ethyl]-1-(2-phenylethynyl)benzene Traditional Name: 2-[2-(4-amylcyclohexyl)ethyl]-4-hex-1-ynyl-1-(2-phenylethynyl)benzene Formula: C33H42 MolecularWeight: 438.68658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCC2=C(C=CC(=C2)C#CCCCC)C#CC3=CC=CC=C3

Isomeric SMILES

CCCCCC1CCC(CC1)CCC2=C(C=CC(=C2)C#CCCCC)C#CC3=CC=CC=C3

InChI

InChI=1S/C33H42/c1-3-5-7-10-16-31-23-25-32(24-21-28-14-11-8-12-15-28)33(27-31)26-22-30-19-17-29(18-20-30)13-9-6-4-2/h8,11-12,14-15,23,25,27,29-30H,3-7,9,13,17-20,22,26H2,1-2H3