9-butyl-3-[4-(9-butyl-6-ethynyl-carbazol-3-yl)buta-1,3-diynyl]-6-ethynyl-carbazole

Systemtic Name: 9-butyl-3-[4-(9-butyl-6-ethynyl-carbazol-3-yl)buta-1,3-diynyl]-6-ethynyl-carbazole Openeye Name: 9-butyl-3-[4-(9-butyl-6-ethynyl-carbazol-3-yl)buta-1,3-diynyl]-6-ethynyl-carbazole CAS Name: 9-butyl-3-[4-(9-butyl-6-ethynyl-3-carbazolyl)buta-1,3-diynyl]-6-ethynylcarbazole IUPAC Name: 9-butyl-3-[4-(9-butyl-6-ethynylcarbazol-3-yl)buta-1,3-diynyl]-6-ethynylcarbazole Traditional Name: 9-butyl-3-[4-(9-butyl-6-ethynyl-carbazol-3-yl)buta-1,3-diynyl]-6-ethynyl-carbazole Formula: C40H32N2 MolecularWeight: 540.69548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)C#C)C3=C1C=CC(=C3)C#CC#CC4=CC5=C(C=C4)N(C6=C5C=C(C=C6)C#C)CCCC

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)C#C)C3=C1C=CC(=C3)C#CC#CC4=CC5=C(C=C4)N(C6=C5C=C(C=C6)C#C)CCCC

InChI

InChI=1S/C40H32N2/c1-5-9-23-41-37-19-15-29(7-3)25-33(37)35-27-31(17-21-39(35)41)13-11-12-14-32-18-22-40-36(28-32)34-26-30(8-4)16-20-38(34)42(40)24-10-6-2/h3-4,15-22,25-28H,5-6,9-10,23-24H2,1-2H3