[(E)-3-phenylprop-2-enyl] 2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoate

Systemtic Name: [(E)-3-phenylprop-2-enyl] 2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoate Openeye Name: [(E)-cinnamyl] 2-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanylpropanoate CAS Name: 2-[[2-(4-fluoroanilino)-2-oxoethyl]thio]propanoic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanylpropanoate Traditional Name: 2-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]propionic acid [(E)-cinnamyl] ester Formula: C20H20FNO3S MolecularWeight: 373.441103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC=CC1=CC=CC=C1)SCC(=O)NC2=CC=C(C=C2)F

Isomeric SMILES

CC(C(=O)OC/C=C/C1=CC=CC=C1)SCC(=O)NC2=CC=C(C=C2)F

InChI

InChI=1S/C20H20FNO3S/c1-15(20(24)25-13-5-8-16-6-3-2-4-7-16)26-14-19(23)22-18-11-9-17(21)10-12-18/h2-12,15H,13-14H2,1H3,(H,22,23)/b8-5+