3,6,9,12-tetrakis(diphenylmethylidene)cyclododeca-1,4,7,10-tetrayne

Systemtic Name: 3,6,9,12-tetrakis(diphenylmethylidene)cyclododeca-1,4,7,10-tetrayne Openeye Name: 3,6,9,12-tetrabenzhydrylidenecyclododeca-1,4,7,10-tetrayne CAS Name: 3,6,9,12-tetrakis(diphenylmethylene)cyclododeca-1,4,7,10-tetrayne IUPAC Name: 3,6,9,12-tetrabenzhydrylidenecyclododeca-1,4,7,10-tetrayne Traditional Name: 3,6,9,12-tetrabenzhydrylidenecyclododeca-1,4,7,10-tetrayne Formula: C64H40 MolecularWeight: 809.0024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C2C#CC(=C(C3=CC=CC=C3)C4=CC=CC=C4)C#CC(=C(C5=CC=CC=C5)C6=CC=CC=C6)C#CC(=C(C7=CC=CC=C7)C8=CC=CC=C8)C#C2)C9=CC=CC=C9

Isomeric SMILES

C1=CC=C(C=C1)C(=C2C#CC(=C(C3=CC=CC=C3)C4=CC=CC=C4)C#CC(=C(C5=CC=CC=C5)C6=CC=CC=C6)C#CC(=C(C7=CC=CC=C7)C8=CC=CC=C8)C#C2)C9=CC=CC=C9

InChI

InChI=1S/C64H40/c1-9-25-49(26-10-1)61(50-27-11-2-12-28-50)57-41-43-58(62(51-29-13-3-14-30-51)52-31-15-4-16-32-52)45-47-60(64(55-37-21-7-22-38-55)56-39-23-8-24-40-56)48-46-59(44-42-57)63(53-33-17-5-18-34-53)54-35-19-6-20-36-54/h1-40H