4-butyl-2-hex-1-ynyl-1-(2-phenylethynyl)benzene

Systemtic Name: 4-butyl-2-hex-1-ynyl-1-(2-phenylethynyl)benzene Openeye Name: 4-butyl-2-hex-1-ynyl-1-(2-phenylethynyl)benzene CAS Name: 4-butyl-2-hex-1-ynyl-1-(2-phenylethynyl)benzene IUPAC Name: 4-butyl-2-hex-1-ynyl-1-(2-phenylethynyl)benzene Traditional Name: 4-butyl-2-hex-1-ynyl-1-(2-phenylethynyl)benzene Formula: C24H26 MolecularWeight: 314.46324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=C(C=CC(=C1)CCCC)C#CC2=CC=CC=C2

Isomeric SMILES

CCCCC#CC1=C(C=CC(=C1)CCCC)C#CC2=CC=CC=C2

InChI

InChI=1S/C24H26/c1-3-5-7-11-15-24-20-22(12-6-4-2)17-19-23(24)18-16-21-13-9-8-10-14-21/h8-10,13-14,17,19-20H,3-7,12H2,1-2H3