(E)-3-(4-methylsulfanyl-3-octadecyl-phenyl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(4-methylsulfanyl-3-octadecyl-phenyl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(4-methylsulfanyl-3-octadecyl-phenyl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[4-(methylthio)-3-octadecylphenyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(4-methylsulfanyl-3-octadecylphenyl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[4-(methylthio)-3-stearyl-phenyl]-1-phenyl-prop-2-en-1-one Formula: C34H50OS MolecularWeight: 506.8252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=C(C=CC(=C1)C=CC(=O)C2=CC=CC=C2)SC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=C(C=CC(=C1)/C=C/C(=O)C2=CC=CC=C2)SC

InChI

InChI=1S/C34H50OS/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-24-32-29-30(26-28-34(32)36-2)25-27-33(35)31-22-20-18-21-23-31/h18,20-23,25-29H,3-17,19,24H2,1-2H3/b27-25+