[(E)-3-(4-fluorophenyl)-2-(4-methylsulfonylphenyl)-4-oxidanyl-but-2-enyl] ethanoate

Systemtic Name: [(E)-3-(4-fluorophenyl)-2-(4-methylsulfonylphenyl)-4-oxidanyl-but-2-enyl] ethanoate Openeye Name: [(E)-3-(4-fluorophenyl)-4-hydroxy-2-(4-methylsulfonylphenyl)but-2-enyl] acetate CAS Name: acetic acid [(E)-3-(4-fluorophenyl)-4-hydroxy-2-(4-methylsulfonylphenyl)but-2-enyl] ester IUPAC Name: [(E)-3-(4-fluorophenyl)-4-hydroxy-2-(4-methylsulfonylphenyl)but-2-enyl] acetate Traditional Name: acetic acid [(E)-3-(4-fluorophenyl)-4-hydroxy-2-(4-mesylphenyl)but-2-enyl] ester Formula: C19H19FO5S MolecularWeight: 378.414563

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(=C(CO)C1=CC=C(C=C1)F)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CC(=O)OC/C(=C(/CO)\C1=CC=C(C=C1)F)/C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C19H19FO5S/c1-13(22)25-12-19(15-5-9-17(10-6-15)26(2,23)24)18(11-21)14-3-7-16(20)8-4-14/h3-10,21H,11-12H2,1-2H3/b19-18+