2-[4-(6-carbazol-9-ylheptan-3-yl)phenyl]-5-(4-octylphenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[4-(6-carbazol-9-ylheptan-3-yl)phenyl]-5-(4-octylphenyl)-1,3,4-oxadiazole Openeye Name: 2-[4-(4-carbazol-9-yl-1-ethyl-pentyl)phenyl]-5-(4-octylphenyl)-1,3,4-oxadiazole CAS Name: 2-[4-[6-(9-carbazolyl)heptan-3-yl]phenyl]-5-(4-octylphenyl)-1,3,4-oxadiazole IUPAC Name: 2-[4-(6-carbazol-9-ylheptan-3-yl)phenyl]-5-(4-octylphenyl)-1,3,4-oxadiazole Traditional Name: 2-[4-(4-carbazol-9-yl-1-ethyl-pentyl)phenyl]-5-(4-octylphenyl)-1,3,4-oxadiazole Formula: C41H47N3O MolecularWeight: 597.83138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)C(CC)CCC(C)N4C5=CC=CC=C5C6=CC=CC=C64

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(C=C3)C(CC)CCC(C)N4C5=CC=CC=C5C6=CC=CC=C64

InChI

InChI=1S/C41H47N3O/c1-4-6-7-8-9-10-15-31-21-24-34(25-22-31)40-42-43-41(45-40)35-28-26-33(27-29-35)32(5-2)23-20-30(3)44-38-18-13-11-16-36(38)37-17-12-14-19-39(37)44/h11-14,16-19,21-22,24-30,32H,4-10,15,20,23H2,1-3H3