4-[5-(3,4,5-tridodecoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline

Systemtic Name: 4-[5-(3,4,5-tridodecoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline Openeye Name: 4-[5-(3,4,5-tridodecoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline CAS Name: 4-[5-(3,4,5-tridodecoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline IUPAC Name: 4-[5-(3,4,5-tridodecoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline Traditional Name: [4-[5-(3,4,5-trilauryloxyphenyl)-1,3,4-oxadiazol-2-yl]phenyl]amine Formula: C50H83N3O4 MolecularWeight: 790.21172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCCCCC)OCCCCCCCCCCCC)C2=NN=C(O2)C3=CC=C(C=C3)N

Isomeric SMILES

CCCCCCCCCCCCOC1=CC(=CC(=C1OCCCCCCCCCCCC)OCCCCCCCCCCCC)C2=NN=C(O2)C3=CC=C(C=C3)N

InChI

InChI=1S/C50H83N3O4/c1-4-7-10-13-16-19-22-25-28-31-38-54-46-41-44(50-53-52-49(57-50)43-34-36-45(51)37-35-43)42-47(55-39-32-29-26-23-20-17-14-11-8-5-2)48(46)56-40-33-30-27-24-21-18-15-12-9-6-3/h34-37,41-42H,4-33,38-40,51H2,1-3H3