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

Systemtic Name: 4-hexyl-2-oct-1-ynyl-1-(2-phenylethynyl)benzene Openeye Name: 4-hexyl-2-oct-1-ynyl-1-(2-phenylethynyl)benzene CAS Name: 4-hexyl-2-oct-1-ynyl-1-(2-phenylethynyl)benzene IUPAC Name: 4-hexyl-2-oct-1-ynyl-1-(2-phenylethynyl)benzene Traditional Name: 4-hexyl-2-oct-1-ynyl-1-(2-phenylethynyl)benzene Formula: C28H34 MolecularWeight: 370.56956

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=C(C=CC(=C1)CCCCCC)C#CC2=CC=CC=C2

Isomeric SMILES

CCCCCCC#CC1=C(C=CC(=C1)CCCCCC)C#CC2=CC=CC=C2

InChI

InChI=1S/C28H34/c1-3-5-7-9-10-15-19-28-24-26(18-12-8-6-4-2)21-23-27(28)22-20-25-16-13-11-14-17-25/h11,13-14,16-17,21,23-24H,3-10,12,18H2,1-2H3