4-[9-hexadecyl-6-[4-[9-hexadecyl-6-(3-methyl-3-oxidanyl-but-1-ynyl)carbazol-3-yl]buta-1,3-diynyl]carbazol-3-yl]-2-methyl-but-3-yn-2-ol

Systemtic Name: 4-[9-hexadecyl-6-[4-[9-hexadecyl-6-(3-methyl-3-oxidanyl-but-1-ynyl)carbazol-3-yl]buta-1,3-diynyl]carbazol-3-yl]-2-methyl-but-3-yn-2-ol Openeye Name: 4-[9-hexadecyl-6-[4-[9-hexadecyl-6-(3-hydroxy-3-methyl-but-1-ynyl)carbazol-3-yl]buta-1,3-diynyl]carbazol-3-yl]-2-methyl-but-3-yn-2-ol CAS Name: 4-[9-hexadecyl-6-[4-[9-hexadecyl-6-(3-hydroxy-3-methylbut-1-ynyl)-3-carbazolyl]buta-1,3-diynyl]-3-carbazolyl]-2-methyl-3-butyn-2-ol IUPAC Name: 4-[9-hexadecyl-6-[4-[9-hexadecyl-6-(3-hydroxy-3-methylbut-1-ynyl)carbazol-3-yl]buta-1,3-diynyl]carbazol-3-yl]-2-methylbut-3-yn-2-ol Traditional Name: 4-[9-cetyl-6-[4-[9-cetyl-6-(3-hydroxy-3-methyl-but-1-ynyl)carbazol-3-yl]buta-1,3-diynyl]carbazol-3-yl]-2-methyl-but-3-yn-2-ol Formula: C70H92N2O2 MolecularWeight: 993.49168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1C2=C(C=C(C=C2)C#CC#CC3=CC4=C(C=C3)N(C5=C4C=C(C=C5)C#CC(C)(C)O)CCCCCCCCCCCCCCCC)C6=C1C=CC(=C6)C#CC(C)(C)O

Isomeric SMILES

CCCCCCCCCCCCCCCCN1C2=C(C=C(C=C2)C#CC#CC3=CC4=C(C=C3)N(C5=C4C=C(C=C5)C#CC(C)(C)O)CCCCCCCCCCCCCCCC)C6=C1C=CC(=C6)C#CC(C)(C)O

InChI

InChI=1S/C70H92N2O2/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-35-51-71-65-43-39-57(53-61(65)63-55-59(41-45-67(63)71)47-49-69(3,4)73)37-33-34-38-58-40-44-66-62(54-58)64-56-60(48-50-70(5,6)74)42-46-68(64)72(66)52-36-32-30-28-26-24-22-20-18-16-14-12-10-8-2/h39-46,53-56,73-74H,7-32,35-36,51-52H2,1-6H3