1,2,3,4,5,6-hexakis(2-phenylethynyl)benzene

Systemtic Name: 1,2,3,4,5,6-hexakis(2-phenylethynyl)benzene Openeye Name: 1,2,3,4,5,6-hexakis(2-phenylethynyl)benzene CAS Name: 1,2,3,4,5,6-hexakis(2-phenylethynyl)benzene IUPAC Name: 1,2,3,4,5,6-hexakis(2-phenylethynyl)benzene Traditional Name: 1,2,3,4,5,6-hexakis(2-phenylethynyl)benzene Formula: C54H30 MolecularWeight: 678.816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=C(C(=C(C(=C2C#CC3=CC=CC=C3)C#CC4=CC=CC=C4)C#CC5=CC=CC=C5)C#CC6=CC=CC=C6)C#CC7=CC=CC=C7

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=C(C(=C(C(=C2C#CC3=CC=CC=C3)C#CC4=CC=CC=C4)C#CC5=CC=CC=C5)C#CC6=CC=CC=C6)C#CC7=CC=CC=C7

InChI

InChI=1S/C54H30/c1-7-19-43(20-8-1)31-37-49-50(38-32-44-21-9-2-10-22-44)52(40-34-46-25-13-4-14-26-46)54(42-36-48-29-17-6-18-30-48)53(41-35-47-27-15-5-16-28-47)51(49)39-33-45-23-11-3-12-24-45/h1-30H