(E)-1-phenyl-3-(2,3,6-trimethoxy-4-octadecylsulfanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-phenyl-3-(2,3,6-trimethoxy-4-octadecylsulfanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-phenyl-3-(2,3,6-trimethoxy-4-octadecylsulfanyl-phenyl)prop-2-en-1-one CAS Name: (E)-1-phenyl-3-[2,3,6-trimethoxy-4-(octadecylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-1-phenyl-3-(2,3,6-trimethoxy-4-octadecylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-1-phenyl-3-[2,3,6-trimethoxy-4-(stearylthio)phenyl]prop-2-en-1-one Formula: C36H54O4S MolecularWeight: 582.87656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSC1=C(C(=C(C(=C1)OC)C=CC(=O)C2=CC=CC=C2)OC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSC1=C(C(=C(C(=C1)OC)/C=C/C(=O)C2=CC=CC=C2)OC)OC

InChI

InChI=1S/C36H54O4S/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-28-41-34-29-33(38-2)31(35(39-3)36(34)40-4)26-27-32(37)30-24-21-20-22-25-30/h20-22,24-27,29H,5-19,23,28H2,1-4H3/b27-26+