1,4-dibutoxy-2,3,5,6-tetrakis[2-(4-ethynylphenyl)ethynyl]benzene

Systemtic Name: 1,4-dibutoxy-2,3,5,6-tetrakis[2-(4-ethynylphenyl)ethynyl]benzene Openeye Name: 1,4-dibutoxy-2,3,5,6-tetrakis[2-(4-ethynylphenyl)ethynyl]benzene CAS Name: 1,4-dibutoxy-2,3,5,6-tetrakis[2-(4-ethynylphenyl)ethynyl]benzene IUPAC Name: 1,4-dibutoxy-2,3,5,6-tetrakis[2-(4-ethynylphenyl)ethynyl]benzene Traditional Name: 1,4-dibutoxy-2,3,5,6-tetrakis[2-(4-ethynylphenyl)ethynyl]benzene Formula: C54H38O2 MolecularWeight: 718.87832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=C(C(=C1C#CC2=CC=C(C=C2)C#C)C#CC3=CC=C(C=C3)C#C)OCCCC)C#CC4=CC=C(C=C4)C#C)C#CC5=CC=C(C=C5)C#C

Isomeric SMILES

CCCCOC1=C(C(=C(C(=C1C#CC2=CC=C(C=C2)C#C)C#CC3=CC=C(C=C3)C#C)OCCCC)C#CC4=CC=C(C=C4)C#C)C#CC5=CC=C(C=C5)C#C

InChI

InChI=1S/C54H38O2/c1-7-13-39-55-53-49(35-31-45-23-15-41(9-3)16-24-45)51(37-33-47-27-19-43(11-5)20-28-47)54(56-40-14-8-2)52(38-34-48-29-21-44(12-6)22-30-48)50(53)36-32-46-25-17-42(10-4)18-26-46/h3-6,15-30H,7-8,13-14,39-40H2,1-2H3