3-[[(2R,4S)-1-(4-fluorophenyl)sulfonyl-4-oxidanyl-pyrrolidin-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[(2R,4S)-1-(4-fluorophenyl)sulfonyl-4-oxidanyl-pyrrolidin-2-yl]carbonylamino]propanoic acid Openeye Name: 3-[[(2R,4S)-1-(4-fluorophenyl)sulfonyl-4-hydroxy-pyrrolidine-2-carbonyl]amino]propanoic acid CAS Name: 3-[[[(2R,4S)-1-(4-fluorophenyl)sulfonyl-4-hydroxy-2-pyrrolidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[(2R,4S)-1-(4-fluorophenyl)sulfonyl-4-hydroxypyrrolidine-2-carbonyl]amino]propanoic acid Traditional Name: 3-[[(2R,4S)-1-(4-fluorophenyl)sulfonyl-4-hydroxy-prolyl]amino]propionic acid Formula: C14H17FN2O6S MolecularWeight: 360.357983

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)NCCC(=O)O)S(=O)(=O)C2=CC=C(C=C2)F)O

Isomeric SMILES

C1[C@@H](CN([C@H]1C(=O)NCCC(=O)O)S(=O)(=O)C2=CC=C(C=C2)F)O

InChI

InChI=1S/C14H17FN2O6S/c15-9-1-3-11(4-2-9)24(22,23)17-8-10(18)7-12(17)14(21)16-6-5-13(19)20/h1-4,10,12,18H,5-8H2,(H,16,21)(H,19,20)/t10-,12+/m0/s1