9-heptyl-3,6-bis[2-[9-heptyl-6-[2-(9-heptylcarbazol-3-yl)ethynyl]carbazol-3-yl]ethynyl]carbazole

Systemtic Name: 9-heptyl-3,6-bis[2-[9-heptyl-6-[2-(9-heptylcarbazol-3-yl)ethynyl]carbazol-3-yl]ethynyl]carbazole Openeye Name: 9-heptyl-3,6-bis[2-[9-heptyl-6-[2-(9-heptylcarbazol-3-yl)ethynyl]carbazol-3-yl]ethynyl]carbazole CAS Name: 9-heptyl-3,6-bis[2-[9-heptyl-6-[2-(9-heptyl-3-carbazolyl)ethynyl]-3-carbazolyl]ethynyl]carbazole IUPAC Name: 9-heptyl-3,6-bis[2-[9-heptyl-6-[2-(9-heptylcarbazol-3-yl)ethynyl]carbazol-3-yl]ethynyl]carbazole Traditional Name: 9-heptyl-3,6-bis[2-[9-heptyl-6-[2-(9-heptylcarbazol-3-yl)ethynyl]carbazol-3-yl]ethynyl]carbazole Formula: C103H107N5 MolecularWeight: 1414.98518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C2=C(C=C(C=C2)C#CC3=CC4=C(C=C3)N(C5=C4C=C(C=C5)C#CC6=CC7=C(C=C6)N(C8=CC=CC=C87)CCCCCCC)CCCCCCC)C9=C1C=CC(=C9)C#CC1=CC2=C(C=C1)N(C1=C2C=C(C=C1)C#CC1=CC2=C(C=C1)N(C1=CC=CC=C12)CCCCCCC)CCCCCCC

Isomeric SMILES

CCCCCCCN1C2=C(C=C(C=C2)C#CC3=CC4=C(C=C3)N(C5=C4C=C(C=C5)C#CC6=CC7=C(C=C6)N(C8=CC=CC=C87)CCCCCCC)CCCCCCC)C9=C1C=CC(=C9)C#CC1=CC2=C(C=C1)N(C1=C2C=C(C=C1)C#CC1=CC2=C(C=C1)N(C1=CC=CC=C12)CCCCCCC)CCCCCCC

InChI

InChI=1S/C103H107N5/c1-6-11-16-21-30-63-104-94-37-28-26-35-84(94)86-68-76(47-55-96(86)104)39-41-78-49-57-98-88(70-78)90-72-80(51-59-100(90)106(98)65-32-23-18-13-8-3)43-45-82-53-61-102-92(74-82)93-75-83(54-62-103(93)108(102)67-34-25-20-15-10-5)46-44-81-52-60-101-91(73-81)89-71-79(50-58-99(89)107(101)66-33-24-19-14-9-4)42-40-77-48-56-97-87(69-77)85-36-27-29-38-95(85)105(97)64-31-22-17-12-7-2/h26-29,35-38,47-62,68-75H,6-25,30-34,63-67H2,1-5H3