(E)-3-[3,4-di(icosoxy)phenyl]-1-(4-propylsulfanylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[3,4-di(icosoxy)phenyl]-1-(4-propylsulfanylphenyl)prop-2-en-1-one Openeye Name: (E)-3-[3,4-di(icosoxy)phenyl]-1-(4-propylsulfanylphenyl)prop-2-en-1-one CAS Name: (E)-3-[3,4-di(eicosoxy)phenyl]-1-[4-(propylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-3-[3,4-di(icosoxy)phenyl]-1-(4-propylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(3,4-diarachyloxyphenyl)-1-[4-(propylthio)phenyl]prop-2-en-1-one Formula: C58H98O3S MolecularWeight: 875.46192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)SCCC)OCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)SCCC)OCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C58H98O3S/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-49-60-57-48-42-53(41-47-56(59)54-43-45-55(46-44-54)62-51-6-3)52-58(57)61-50-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-5-2/h41-48,52H,4-40,49-51H2,1-3H3/b47-41+