prop-2-enyl (2S,4S)-4-ethanoylsulfanyl-2-(2-fluoranylpropoxymethyl)pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl (2S,4S)-4-ethanoylsulfanyl-2-(2-fluoranylpropoxymethyl)pyrrolidine-1-carboxylate Openeye Name: allyl (2S,4S)-4-acetylsulfanyl-2-(2-fluoropropoxymethyl)pyrrolidine-1-carboxylate CAS Name: (2S,4S)-4-(acetylthio)-2-(2-fluoropropoxymethyl)-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2S,4S)-4-acetylsulfanyl-2-(2-fluoropropoxymethyl)pyrrolidine-1-carboxylate Traditional Name: (2S,4S)-4-(acetylthio)-2-(2-fluoropropoxymethyl)pyrrolidine-1-carboxylic acid allyl ester Formula: C14H22FNO4S MolecularWeight: 319.392183

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Descriptors Computed from Structure

Canonical SMILES:

CC(COCC1CC(CN1C(=O)OCC=C)SC(=O)C)F

Isomeric SMILES

CC(COC[C@@H]1C[C@@H](CN1C(=O)OCC=C)SC(=O)C)F

InChI

InChI=1S/C14H22FNO4S/c1-4-5-20-14(18)16-7-13(21-11(3)17)6-12(16)9-19-8-10(2)15/h4,10,12-13H,1,5-9H2,2-3H3/t10?,12-,13-/m0/s1