(E)-1-phenyl-3-(2,3,5,6-tetramethoxy-4-octadecylsulfanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-phenyl-3-(2,3,5,6-tetramethoxy-4-octadecylsulfanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-phenyl-3-(2,3,5,6-tetramethoxy-4-octadecylsulfanyl-phenyl)prop-2-en-1-one CAS Name: (E)-1-phenyl-3-[2,3,5,6-tetramethoxy-4-(octadecylthio)phenyl]-2-propen-1-one IUPAC Name: (E)-1-phenyl-3-(2,3,5,6-tetramethoxy-4-octadecylsulfanylphenyl)prop-2-en-1-one Traditional Name: (E)-1-phenyl-3-[2,3,5,6-tetramethoxy-4-(stearylthio)phenyl]prop-2-en-1-one Formula: C37H56O5S MolecularWeight: 612.90254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSC1=C(C(=C(C(=C1OC)OC)C=CC(=O)C2=CC=CC=C2)OC)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSC1=C(C(=C(C(=C1OC)OC)/C=C/C(=O)C2=CC=CC=C2)OC)OC

InChI

InChI=1S/C37H56O5S/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-29-43-37-35(41-4)33(39-2)31(34(40-3)36(37)42-5)27-28-32(38)30-25-22-21-23-26-30/h21-23,25-28H,6-20,24,29H2,1-5H3/b28-27+