(2S)-2-[3-(4-fluorophenyl)sulfonylpropanoylamino]propanoic acid

Systemtic Name: (2S)-2-[3-(4-fluorophenyl)sulfonylpropanoylamino]propanoic acid Openeye Name: (2S)-2-[3-(4-fluorophenyl)sulfonylpropanoylamino]propanoic acid CAS Name: (2S)-2-[[3-(4-fluorophenyl)sulfonyl-1-oxopropyl]amino]propanoic acid IUPAC Name: (2S)-2-[3-(4-fluorophenyl)sulfonylpropanoylamino]propanoic acid Traditional Name: (2S)-2-[3-(4-fluorophenyl)sulfonylpropanoylamino]propionic acid Formula: C12H14FNO5S MolecularWeight: 303.306663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NC(=O)CCS(=O)(=O)C1=CC=C(C=C1)F

Isomeric SMILES

C[C@@H](C(=O)O)NC(=O)CCS(=O)(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C12H14FNO5S/c1-8(12(16)17)14-11(15)6-7-20(18,19)10-4-2-9(13)3-5-10/h2-5,8H,6-7H2,1H3,(H,14,15)(H,16,17)/t8-/m0/s1