(E)-3-(3-icosoxy-4-propylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(3-icosoxy-4-propylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(3-icosoxy-4-propylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[3-eicosoxy-4-(propylthio)phenyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(3-icosoxy-4-propylsulfanylphenyl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[3-arachyloxy-4-(propylthio)phenyl]-1-phenyl-prop-2-en-1-one Formula: C38H58O2S MolecularWeight: 578.93092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C38H58O2S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-31-40-37-33-34(28-30-38(37)41-32-4-2)27-29-36(39)35-25-22-21-23-26-35/h21-23,25-30,33H,3-20,24,31-32H2,1-2H3/b29-27+