2-but-1-ynyl-4-hexyl-1-(2-phenylethynyl)benzene

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(C=C1)C#CC2=CC=CC=C2)C#CCC

Isomeric SMILES

CCCCCCC1=CC(=C(C=C1)C#CC2=CC=CC=C2)C#CCC

InChI

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