(2-morpholin-4-yl-2-oxidanylidene-ethyl) (2S)-1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) (2S)-1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: (2-morpholino-2-oxo-ethyl) (2S)-1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: (2S)-1-(2-fluorophenyl)sulfonyl-2-pyrrolidinecarboxylic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) (2S)-1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-fluorophenyl)sulfonylpyrrolidine-2-carboxylic acid (2-keto-2-morpholino-ethyl) ester Formula: C17H21FN2O6S MolecularWeight: 400.421843

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CC=C2F)C(=O)OCC(=O)N3CCOCC3

Isomeric SMILES

C1C[C@H](N(C1)S(=O)(=O)C2=CC=CC=C2F)C(=O)OCC(=O)N3CCOCC3

InChI

InChI=1S/C17H21FN2O6S/c18-13-4-1-2-6-15(13)27(23,24)20-7-3-5-14(20)17(22)26-12-16(21)19-8-10-25-11-9-19/h1-2,4,6,14H,3,5,7-12H2/t14-/m0/s1