(E)-3-[4-butylsulfanyl-3,5-di(henicosoxy)phenyl]-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-[4-butylsulfanyl-3,5-di(henicosoxy)phenyl]-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-[4-butylsulfanyl-3,5-di(henicosoxy)phenyl]-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[4-(butylthio)-3,5-di(heneicosoxy)phenyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-[4-butylsulfanyl-3,5-di(henicosoxy)phenyl]-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[4-(butylthio)-3,5-di(heneicosoxy)phenyl]-1-phenyl-prop-2-en-1-one Formula: C61H104O3S MolecularWeight: 917.54166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1SCCCC)OCCCCCCCCCCCCCCCCCCCCC)C=CC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCOC1=CC(=CC(=C1SCCCC)OCCCCCCCCCCCCCCCCCCCCC)/C=C/C(=O)C2=CC=CC=C2

InChI

InChI=1S/C61H104O3S/c1-4-7-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-45-51-63-59-54-56(49-50-58(62)57-47-43-42-44-48-57)55-60(61(59)65-53-9-6-3)64-52-46-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-8-5-2/h42-44,47-50,54-55H,4-41,45-46,51-53H2,1-3H3/b50-49+