4-[3,5-bis(docosylideneamino)phenyl]sulfanylphenol

Systemtic Name: 4-[3,5-bis(docosylideneamino)phenyl]sulfanylphenol Openeye Name: 4-[3,5-bis(docosylideneamino)phenyl]sulfanylphenol CAS Name: 4-[[3,5-bis(docosylideneamino)phenyl]thio]phenol IUPAC Name: 4-[3,5-bis(docosylideneamino)phenyl]sulfanylphenol Traditional Name: 4-[[3,5-bis(docosylideneamino)phenyl]thio]phenol Formula: C56H96N2OS MolecularWeight: 845.43924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC=NC1=CC(=CC(=C1)SC2=CC=C(C=C2)O)N=CCCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC=NC1=CC(=CC(=C1)SC2=CC=C(C=C2)O)N=CCCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C56H96N2OS/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-47-57-52-49-53(51-56(50-52)60-55-45-43-54(59)44-46-55)58-48-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h43-51,59H,3-42H2,1-2H3