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

Systemtic Name: (E)-3-(4-methylsulfanyl-3-octadecoxy-phenyl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(4-methylsulfanyl-3-octadecoxy-phenyl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[4-(methylthio)-3-octadecoxyphenyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(4-methylsulfanyl-3-octadecoxyphenyl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[4-(methylthio)-3-stearyloxy-phenyl]-1-phenyl-prop-2-en-1-one Formula: C34H50O2S MolecularWeight: 522.8246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=C(C=CC(=C1)C=CC(=O)C2=CC=CC=C2)SC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=C(C=CC(=C1)/C=C/C(=O)C2=CC=CC=C2)SC

InChI

InChI=1S/C34H50O2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-28-36-33-29-30(25-27-34(33)37-2)24-26-32(35)31-22-19-18-20-23-31/h18-20,22-27,29H,3-17,21,28H2,1-2H3/b26-24+