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9-(12-phenanthren-9-yldodeca-1,3,5,7,9,11-hexaynyl)phenanthrene

9-(12-phenanthren-9-yldodeca-1,3,5,7,9,11-hexaynyl)phenanthrene

Systemtic Name:9-(12-phenanthren-9-yldodeca-1,3,5,7,9,11-hexaynyl)phenanthrene
Openeye Name:9-[12-(9-phenanthryl)dodeca-1,3,5,7,9,11-hexaynyl]phenanthrene
CAS Name:9-[12-(9-phenanthrenyl)dodeca-1,3,5,7,9,11-hexaynyl]phenanthrene
IUPAC Name:9-(12-phenanthren-9-yldodeca-1,3,5,7,9,11-hexaynyl)phenanthrene
Traditional Name:9-[12-(9-phenanthryl)dodeca-1,3,5,7,9,11-hexaynyl]phenanthrene
Formula: C40H18
MolecularWeight: 498.57092
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C#CC#CC#CC#CC#CC#CC4=CC5=CC=CC=C5C6=CC=CC=C64


Isomeric SMILES

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C#CC#CC#CC#CC#CC#CC4=CC5=CC=CC=C5C6=CC=CC=C64


InChI

InChI=1S/C40H18/c1(3-5-7-9-19-31-29-33-21-11-13-23-35(33)39-27-17-15-25-37(31)39)2-4-6-8-10-20-32-30-34-22-12-14-24-36(34)40-28-18-16-26-38(32)40/h11-18,21-30H


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