(4-methylsulfanylphenyl)methyl (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate

Systemtic Name: (4-methylsulfanylphenyl)methyl (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate Openeye Name: (4-methylsulfanylphenyl)methyl (E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-2-propenoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)acrylic acid [4-(methylthio)benzyl] ester Formula: C17H14BrFO2S MolecularWeight: 381.259263

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)COC(=O)C=CC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CSC1=CC=C(C=C1)COC(=O)/C=C/C2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C17H14BrFO2S/c1-22-15-6-2-12(3-7-15)11-21-17(20)9-4-13-10-14(18)5-8-16(13)19/h2-10H,11H2,1H3/b9-4+